# cif

formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #39 based on stacking sequence ABABACABCBAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #40a based on stacking sequence ABABACACBABC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Mg Si O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #40b based on stacking sequence ABABACACBABC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #41 based on stacking sequence ABABACACBCAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #42a based on stacking sequence ABABACBABCBC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Mg Si O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #42b based on stacking sequence ABABACBABCBC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #43 based on stacking sequence ABABACBACABC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #44 based on stacking sequence ABABACBCACBC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #45a based on stacking sequence ABABCABABCAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Mg Si O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #45b based on stacking sequence ABABCABABCAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #46a based on stacking sequence ABABCABACABC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Mg Si O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #46b based on stacking sequence ABABCABACABC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #47a based on stacking sequence ABABCABACBAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Mg Si O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #47b based on stacking sequence ABABCABACBAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #48a based on stacking sequence ABABCABCABAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Mg Si O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #48b based on stacking sequence ABABCABCABAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #49a based on stacking sequence ABABCABCACBC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Mg Si O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #49b based on stacking sequence ABABCABCACBC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #50 based on stacking sequence ABABCACBABAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #51a based on stacking sequence ABABCBABCBAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Mg Si O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #51b based on stacking sequence ABABCBABCBAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #52 based on stacking sequence ABABCBACBCAC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #53 based on stacking sequence ABACABACBABC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: Si Mg O3
compound: <missing>
formula_title: <missing>
a: 19.595917
b: 6
c: 3.4641016
alpha: 90
beta: 90.
gamma: 90
cell_volume: 407.293
crystal_density: 9.823
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Model pyroxenes I: Ideal pyroxene topologies
 Pyroxene #54 based on stacking sequence ABACABCBACBC
 Note: Atoms Mg, Si, and O are assigned to atomic positions just for convenience.

atoms_y:

atoms_z:


formula: U8 S4 (Mg2.16 Mn.84) O68 H58
compound: La Creusaz uranium prospect near Les Marecottes, Western Swiss Alps, Switzerland
formula_title: <missing>
a: 10.815
b: 11.249
c: 13.851
alpha: 66.224
beta: 72.412
gamma: 69.955
cell_volume: 1422.057
crystal_density: 3.827
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Contribution to the mineralogy of acid drainage of uranium minerals:
 Marecottite and the zippeite-group

atoms_sites:
["U1", "U2", "U3", "U4", "S1", "S2", "Mg1", "Mn1", "Mg2", "Mn2", "Mg3", "Mn3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O-H18", "O19", "O20", "Wat21", "Wat22", "Wat23", "Wat24", "Wat25", "Wat26", "Wat27", "Wat28", "Wat29", "Wat30", "Wat31", "Wat32", "Wat33", "Wat34"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
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formula: Na4 U C3 O11
compound: <missing>
pub_title: Cejkaite, the triclinic polymorph of Na4(UO2)(CO3)3 - a new mineral from Jachymov, Czech Republic
formula_title: <missing>
a: 9.291
b: 9.292
c: 12.895
alpha: 90.73
beta: 90.82
gamma: 120.00
cell_volume: 963.750
crystal_density: 3.736
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
atoms_sites:
["Na1", "Na1a", "Na2", "Na3", "Na3a", "Na3b", "Na3c", "Na3d", "Na3e", "U1", "U1a", "C1", "C1a", "C1b", "C1c", "C1d", "C1e", "O1", "O1a", "O2", "O2a", "O11", "O11a", "O11b", "O11c", "O11d", "O11e", "O12", "O12a", "O12b", "O12c", "O12d", "O12e", "O13", "O13a", "O13b", "O13c", "O13d", "O13e"]

atoms_x:

atoms_y:

atoms_z:

qdat:
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formula: Fe2 O4 Cl.42 H2.32
compound: <missing>
pub_title: Neutron and temperature-resolved synchrotron X-ray powder diffraction study of akaganeite
formula_title: <missing>
a: 10.587
b: 3.0311
c: 10.515
alpha: 90
beta: 90.03
gamma: 90
cell_volume: 337.429
crystal_density: 3.798
atoms_sites: ["Fe1", "Fe2", "O1", "O2", "O3", "O4", "Cl", "H1", "H2", "H3"]
atoms_x: ACY0AMARFQBgdygAwGcoACD7EQBgSAIAAAAAAGBmFgCAPRUAYJf5/w==
atoms_y: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgA4IAED7BQAAawMAAAAAAA==
atoms_z: AOYUAKDZCACwmBEAUJ4CAPBzFAAg1hMAAAAAAEA1JgAguBgAQHIHAA==
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AgKIZAICEHgCAhB4AAIgTAA==
atoms_u_iso: 8AQBAPAEAQCgvgAAoL4AAKC+AACgvgAA4JMEAKCMAACgjAAAoIwAAA==
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
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atoms_aniso_u23: 0
qdat:
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formula: (Ti Mg2) O4
compound: <missing>
formula_title: <missing>
a: 8.4469
b: 8.4469
c: 8.4469
alpha: 90
beta: 90
gamma: 90
cell_volume: 602.687
crystal_density: 3.537
atoms_sites: ["Ti", "Mg", "MgT", "TiT", "O"]
atoms_x: gIQeAICEHgAgoQcAIKEHACDuDwA=
atoms_y: gIQeAICEHgAgoQcAIKEHACDuDwA=
atoms_z: gIQeAICEHgAgoQcAIKEHACDuDwA=
atoms_occupancy: cF0eAJCrHgDgujwAIE4AAAAJPQA=
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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: First series, T = 90 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: First series, T = 70 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: First series, T = 97 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: First series, T = 152 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: First series, T = 220 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 289 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 360 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 425 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 483 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 559 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 625 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 690 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 756 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 820 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: First series, T = 885 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 949 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 1020 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: First series, T = 1054 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 100 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 240 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 559 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 850 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 912 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 975 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 1039 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 1103 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 1167 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 1232 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 1297 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 1359 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 1403 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 1416 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 1397 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 1346 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 1283 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 1219 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 1081 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 944 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 882 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 797 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 756 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 693 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 630 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 567 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 503 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 439 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
 qandilite Mg2TiO4 at high temperature
 Sample: Second series, T = 375 C

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formula: Ti Mg2 O4
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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 312 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 250 C

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formula: Ti Mg2 O4
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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 198 C

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pub_title:
 An in situ neutron diffraction study of cation disordering in synthetic
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 Sample: Second series, T = 168 C

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formula: U3 Ca C2 O20 H12
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pub_title: A new uranyl carbonate sheet in the crystal structure of fontanite, Ca[(UO2)3(CO3)2O2](H2O)6
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formula: Pb3 O4
compound: <missing>
formula_title: <missing>
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b: 6.4610
c: 3.3168
alpha: 90
beta: 90
gamma: 90
cell_volume: 201.038
crystal_density: 11.326
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pub_title:
 Bulk modulus and high-pressure crystal structures of minium, Pb3O4,
 determined by X-ray powder diffraction
 Sample: Phase III of Pb3O4 at 13.3 GPa

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formula: Na Cr Si2 O6
compound: <missing>
formula_title: <missing>
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beta: 107.498
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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 0.0001 GPa
 Note: altered y-coordinate of O2

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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 1.14 GPa

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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 2.22 GPa

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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 3.53 GPa

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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 5.05 GPa

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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 5.78 GPa

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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
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 Sample: P = 6.25 GPa

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formula: Na Cr Si2 O6
compound: <missing>
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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 7.08 GPa

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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 7.23 GPa

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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 7.39 GPa

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formula: Na Cr Si2 O6
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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 8.50 GPa

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formula: Na Cr Si2 O6
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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
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 Sample: P = 8.97 GPa

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formula: Na Cr Si2 O6
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pub_title:
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 9.28 GPa

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formula: Ca2 Fe2.688 Al.312 Si3 O14 H4
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pub_title:
 The crystal chemistry of julgoldite-Fe3+ from Bombay, India, studied using
 synchrotron X-ray powder diffraction and 57Fe Mossbauer spectroscopy

atoms_sites:
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formula: O6 Si2 Mg.922 Fe.838 Mn.027 Ca.195
compound: Parana, Brazil
formula_title: <missing>
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pub_title:
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-1, before heat treatment

atoms_sites:
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pub_title:
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-2, after heating at 700 deg C

atoms_sites:
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formula_title: <missing>
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pub_title:
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-3, after heating at 750 deg C

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pub_title:
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-4, after heating at 800 deg C

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formula: O6 Si2 Mg.921 Fe.85 Mn.027 Ca.179
compound: Parana, Brazil
formula_title: <missing>
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pub_title:
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-5, after heating at 850 deg C

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formula: O6 Si2 Mg.942 Fe.834 Mn.027 Ca.18
compound: Parana, Brazil
formula_title: <missing>
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pub_title:
 Coupling between non-convergent ordering and transition temperature
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 Sample: BTS-308 n.17-6, after the final in situ run to 500 deg C

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formula: U O8 H8
compound: <missing>
pub_title: Studtite, [(UO2)(O2)(H2O)2](H2O)2: The first structure of a peroxide mineral
formula_title: <missing>
a: 14.068
b: 6.721
c: 8.428
alpha: 90
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gamma: 90
cell_volume: 665.607
crystal_density: 3.733
atoms_sites: ["U1", "O1", "O2", "O3", "O4", "H1", "H2", "H3", "H4"]
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formula: Mn12 Si20 O61 H18 Ca K
compound: <missing>
formula_title: <missing>
a: 16.8146
b: 25.2036
c: 13.3866
alpha: 90
beta: 90
gamma: 90
cell_volume: 5673.086
crystal_density: 2.686
atoms_occupancy: 0
pub_title:
 The atomic arrangemetn of the ganophyllite-group modulated layer silicates as
 determined from the orthorhombic dimorph of tamaite, with the elusive 16.8 A
 ganophyllite-group superstructure revealed
 Note: signs of the y-coordinates for O24 and O25 have been changed

atoms_sites:
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atoms_x:

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formula: Ca Ti2 O6
compound: <missing>
pub_title: The crystal structure of chromian kassite from the Saranovskoye deposit, Northern Urals, Russia
formula_title: <missing>
a: 5.275
b: 9.009
c: 9.557
alpha: 90
beta: 90.43
gamma: 90
cell_volume: 454.160
crystal_density: 3.391
atoms_sites: ["Ca", "Ti1", "Ti2", "O1", "O1a", "O2", "O2a", "O3", "O3a"]
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qdat:
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formula: Na.693 Ca.011 K.002 Al7.308 Mn1.233 Fe.021 Li.378 Si5.928 B3 O30.57 F.48 H3.25
compound: Eibenstein an der Thaya, Lower Austria
formula_title: <missing>
a: 15.9466
b: 15.9466
c: 7.1384
alpha: 90
beta: 90
gamma: 120
cell_volume: 1572.055
crystal_density: 3.123
atoms_aniso_label: "<missing>"
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pub_title:
 Mn-rich tourmaline from Austria: structure, chemistry, optical spectra, and
 relations to synthetic solid solutions
 Note: This sample may be named wrong
 Sample BT

atoms_sites:
["NaX", "CaX", "KX", "AlY", "Mn2Y", "Fe2Y", "LiY", "AlZ", "SiT", "AlT", "B", "O1", "F1", "O-H1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "H3"]

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formula: Na.773 Ca.032 K.004 Al7.407 Mn1.143 Fe.018 Li.483 Ti.006 Si5.826 B3 O30.52 F.48 H3.33
compound: Eibenstein an der Thaya, Lower Austria
formula_title: <missing>
a: 15.941
b: 15.941
c: 7.136
alpha: 90
beta: 90
gamma: 120
cell_volume: 1570.423
crystal_density: 3.119
atoms_aniso_label: "<missing>"
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pub_title:
 Mn-rich tourmaline from Austria: structure, chemistry, optical spectra, and
 relations to synthetic solid solutions
 Note: This sample may be named wrong
 Sample P6

atoms_sites:
["NaX", "CaX", "KX", "AlY", "Mn2Y", "Fe2Y", "LiY", "TiY", "AlZ", "SiT", "AlT", "B", "O1", "O-H1", "F1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "H3"]

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pub_title: Structural systematics of hydrous ringwoodite and water in Earth's interior Sample: Ringby5
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pub_title: Structural systematics of hydrous ringwoodite and water in Earth's interior Sample: SZ9901
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pub_title: Variation of hydrogen bonded O...O distances in goethite at high pressure Sample at P = 0.5 GPa
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pub_title: Variation of hydrogen bonded O...O distances in goethite at high pressure Sample at P = 2.8 GPa
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pub_title: Variation of hydrogen bonded O...O distances in goethite at high pressure Sample at P = 6.3 GPa
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formula: Fe O2
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pub_title: Variation of hydrogen bonded O...O distances in goethite at high pressure Sample at P = 9.0 GPa
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pub_title:
 Pressure-controlled polytypism in hydrous layered materials
 Sample: Low pressure dickite at P = 0.1 MPa

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pub_title:
 Pressure-controlled polytypism in hydrous layered materials
 Sample: High pressure dickite at P = 4.1 GPa

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pub_title:
 Pressure-induced phase transformation of kalicinite (KHCO3) at 2.8 GPa
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 Sample: at P = 0 GPa

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pub_title:
 Pressure-induced phase transformation of kalicinite (KHCO3) at 2.8 GPa
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 Sample: at P = 0.2 GPa

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pub_title:
 Pressure-induced phase transformation of kalicinite (KHCO3) at 2.8 GPa
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 Sample: at P = 1.8 GPa

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atoms_aniso_u23: 0
pub_title:
 Pressure-induced phase transformation of kalicinite (KHCO3) at 2.8 GPa
 and local structural changes around hydrogen atoms
 Sample: at P = 2.3 GPa

qdat:
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formula_title: <missing>
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gamma: 90
cell_volume: 279.241
crystal_density: 2.405
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pub_title:
 Pressure-induced phase transformation of kalicinite (KHCO3) at 2.8 GPa
 and local structural changes around hydrogen atoms
 Sample: at P = 2.5 GPa

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pub_title:
 Single-crystal in situ high-temperature structural investigation of the I-1 - I2/c phase
 transition in Ca0.2Sr0.8Al2Si2O8 feldspar
 T = 20 C

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formula_title: <missing>
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pub_title:
 Single-crystal in situ high-temperature structural investigation of the I-1 - I2/c phase
 transition in Ca0.2Sr0.8Al2Si2O8 feldspar
 T = 200 C

atoms_sites:
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compound: <missing>
formula_title: <missing>
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alpha: 90.46
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cell_volume: 1400.001
crystal_density: 3.001
pub_title:
 Single-crystal in situ high-temperature structural investigation of the I-1 - I2/c phase
 transition in Ca0.2Sr0.8Al2Si2O8 feldspar
 T = 400 C

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formula: (Ca.2 Sr.8) Si2 Al2 O8
compound: <missing>
formula_title: <missing>
a: 8.379
b: 12.971
c: 14.278
alpha: 90.11
beta: 115.48
gamma: 90.06
cell_volume: 1400.851
crystal_density: 2.999
pub_title:
 Single-crystal in situ high-temperature structural investigation of the I-1 - I2/c phase
 transition in Ca0.2Sr0.8Al2Si2O8 feldspar
 T = 500 C

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formula: (Ca.2 Sr.8) Si2 Al2 O8
compound: <missing>
formula_title: <missing>
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b: 12.970
c: 14.283
alpha: 90
beta: 115.46
gamma: 90
cell_volume: 1402.642
crystal_density: 2.995
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pub_title:
 Single-crystal in situ high-temperature structural investigation of the I-1 - I2/c phase
 transition in Ca0.2Sr0.8Al2Si2O8 feldspar
 T = 620 C

atoms_sites:
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formula: Mn6.88 Zn1.405 O19.36 H10.72
compound: <missing>
pub_title: Woodruffite: A new Mn oxide structure with 3x4 tunnels Sample: at T = 100 K
formula_title: <missing>
a: 24.765
b: 2.8473
c: 9.559
alpha: 90
beta: 93.77
gamma: 90
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pub_title: Crystal structure of protoanthophyllite: A new mineral from the Takese ultramafic complex, Japan
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pub_title:
 Alacranite, As8S9: structural study of the holotype and re-assignment
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pub_title:
 Composition, Fe3+/Sum(Fe), and crystal structure of non-asbestiform and
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pub_title:
 Dehydration dynamics of bikitaite: I. In situ synchrotron powder X-ray diffraction study
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pub_title:
 Dehydration dynamics of bikitaite: I. In situ synchrotron powder X-ray diffraction study
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pub_title:
 Dehydration dynamics of bikitaite: I. In situ synchrotron powder X-ray diffraction study
 Sample: T = 400

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pub_title:
 Dehydration dynamics of bikitaite: I. In situ synchrotron powder X-ray diffraction study
 Sample: T = 468

atoms_sites:
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compound: <missing>
pub_title: The modulated crystal structure of antigorite: The m = 17 polysome
formula_title: <missing>
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compound: <missing>
formula_title: <missing>
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pub_title:
 Structural variations in mercurian tetrahedrite
 Sample A2 from the Spring Creek Claims in Harney County, Oregon

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compound: <missing>
formula_title: <missing>
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alpha: 90
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pub_title:
 Structural variations in mercurian tetrahedrite
 Sample E3 from the Spring Creek Claims in Harney County, Oregon

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compound: <missing>
formula_title: <missing>
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pub_title:
 Structural variations in mercurian tetrahedrite
 Sample C2 from the Spring Creek Claims in Harney County, Oregon

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compound: <missing>
formula_title: <missing>
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alpha: 90
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pub_title:
 Structural variations in mercurian tetrahedrite
 Sample E5 from the Spring Creek Claims in Harney County, Oregon

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formula: Mg1.85 Ca.15 Si2 O6
compound: <missing>
formula_title: <missing>
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b: 8.842
c: 5.201
alpha: 90
beta: 108.35
gamma: 90
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pub_title:
 High pressure behavior, transformation and crystal structure of synthetic iron-free pigeonite
 Sample: P = 0 GPa

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compound: <missing>
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c: 5.149
alpha: 90
beta: 108.12
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pub_title:
 High pressure behavior, transformation and crystal structure of synthetic iron-free pigeonite
 Sample: P = 2.6 GPa

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compound: <missing>
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c: 5.136
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beta: 107.80
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pub_title:
 High pressure behavior, transformation and crystal structure of synthetic iron-free pigeonite
 Sample: P = 4.5 GPa

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formula: Mg1.85 Ca.15 Si2 O6
compound: <missing>
formula_title: <missing>
a: 9.291
b: 8.679
c: 4.963
alpha: 90
beta: 102.22
gamma: 90
cell_volume: 391.132
crystal_density: 3.450
atoms_sites: ["MgM2", "CaM2", "MgM1", "SiT", "O1", "O2", "O3"]
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pub_title:
 High pressure behavior, transformation and crystal structure of synthetic iron-free pigeonite
 Sample: P = 6.2 GPa

qdat:
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formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2879
b: 6.2879
c: 6.2879
alpha: 90
beta: 90
gamma: 90
cell_volume: 248.609
crystal_density: 1.992
atoms_sites: ["K", "Cl"]
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl515031, T = 25 C, P = 0.0 kbar, cell volume = 248.61 ang**3

qdat:
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formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2987
b: 6.2987
c: 6.2987
alpha: 90
beta: 90
gamma: 90
cell_volume: 249.892
crystal_density: 1.982
atoms_sites: ["K", "Cl"]
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57689, T = 36 C, P = 0.4 kbar, cell volume = 249.89 ang**3

qdat:
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compound: <missing>
formula_title: <missing>
a: 6.3122
b: 6.3122
c: 6.3122
alpha: 90
beta: 90
gamma: 90
cell_volume: 251.502
crystal_density: 1.969
atoms_sites: ["K", "Cl"]
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atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl515032, T = 100 C, P = 0.0 kbar, cell volume = 251.50 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAABAAAAAAAAAAEAAAAAAAAIAAAAAAAQAAAAAAQAAAAAAAAAAABAAAAAEAAAAAgAAAAgAAABAAAACAAAAQAAAAAAACAAABAAABAAACAAAEAAAgAACAAAAAAEAAB==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2843
b: 6.2843
c: 6.2843
alpha: 90
beta: 90
gamma: 90
cell_volume: 248.182
crystal_density: 1.995
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57797, T = 100 C, P = 1.9 kbar, cell volume = 248.18 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAQAAAAAAAAACAAAAAAAACAAAAAAAEAAAAAACAAAAAAAAAAAAIAAAAAgAAAAIAAAAEAAAAEAAAAQAAACAAAAAAAAIAAAIAAAIAAAIAAAQAACAAAIAAAAAAIAA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2610
b: 6.2610
c: 6.2610
alpha: 90
beta: 90
gamma: 90
cell_volume: 245.432
crystal_density: 2.018
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57761, T = 100 C, P = 3.9 kbar, cell volume = 245.43 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAIAAAAAAAAAAgAAAAAAAAgAAAAAABAAAAAAAgAAAAAAAAAAACAAAAAIAAAABAAAAAgAAABAAAACAAAAQAAAAAAABAAABAAAAgAABAAACAAAIAABAAAAAAAgA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2137
b: 6.2137
c: 6.2137
alpha: 90
beta: 90
gamma: 90
cell_volume: 239.911
crystal_density: 2.064
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57749, T = 100 C, P = 8.6 kbar, cell volume = 239.91 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAACAAAAAAAAAAIAAAAAAAAIAAAAAAAIAAAAAAEAAAAAAAAAAAAIAAAAAQAAAAEAAAABAAAACAAAAEAAAAQAAAAAAABAAAAgAAAgAABAAABAAAEAAAgAAAAAAQ==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.1573
b: 6.1573
c: 6.1573
alpha: 90
beta: 90
gamma: 90
cell_volume: 233.438
crystal_density: 2.121
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57701, T = 100 C, P = 15.0 kbar, cell volume = 233.44 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAAAQAAAAAAAAAAgAAAAAAAAgAAAAAAAgAAAAAAIAAAAAAAAAAAAQAAAAAgAAAAEAAAABAAAABAAAACAAAAIAAAAAAAAgAAAQAAAIAAAIAAAgAABAAAEAAAAAA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.3361
b: 6.3361
c: 6.3361
alpha: 90
beta: 90
gamma: 90
cell_volume: 254.370
crystal_density: 1.947
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl515033, T = 200 C, P = 0.0 kbar, cell volume = 254.37 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAACAAAAAAAAAAIAAAAAAAAQAAAAAABAAAAAAAgAAAAAAAAAAAEAAAAAQAAAAEAAAACAAAAEAAAAQAAACAAAAAAAAQAAAIAAAQAAAQAABAAAEAAAgAAAAAAgAAQ==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2849
b: 6.2849
c: 6.2849
alpha: 90
beta: 90
gamma: 90
cell_volume: 248.253
crystal_density: 1.995
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57793, T = 200 C, P = 3.1 kbar, cell volume = 248.25 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAQAAAAAAAAACAAAAAAAACAAAAAAAEAAAAAACAAAAAAAAAAAAIAAAAAgAAAAIAAAAEAAAAEAAAAQAAACAAAAAAAAIAAAIAAAIAAAIAAAQAACAAAQAAAAAAIAA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2593
b: 6.2593
c: 6.2593
alpha: 90
beta: 90
gamma: 90
cell_volume: 245.232
crystal_density: 2.019
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57765, T = 200 C, P = 5.5 kbar, cell volume = 245.23 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAIAAAAAAAAAAgAAAAAAAAgAAAAAABAAAAAAAgAAAAAAAAAAACAAAAAIAAAABAAAAAgAAABAAAACAAAAQAAAAAAABAAAAgAAAgAABAAACAAAIAABAAAAAAAgA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2187
b: 6.2187
c: 6.2187
alpha: 90
beta: 90
gamma: 90
cell_volume: 240.491
crystal_density: 2.059
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57745, T = 200 C, P = 10.2 kbar, cell volume = 240.49 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAACAAAAAAAAAAIAAAAAAAAIAAAAAAAIAAAAAAEAAAAAAAAAAAAQAAAAAgAAAAEAAAACAAAACAAAAEAAAAgAAAAAAABAAABAAABAAACAAACAAAIAAAgAAAAAAg==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.1671
b: 6.1671
c: 6.1671
alpha: 90
beta: 90
gamma: 90
cell_volume: 234.554
crystal_density: 2.111
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57705, T = 200 C, P = 15.7 kbar, cell volume = 234.55 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAAAgAAAAAAAAABAAAAAAAABAAAAAAABAAAAAAAQAAAAAAAAAAAAgAAAABAAAAAEAAAACAAAACAAAAEAAAAgAAAAAAABAAAAgAAAQAAAgAABAAACAAAQAAAAAA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.3630
b: 6.3630
c: 6.3630
alpha: 90
beta: 90
gamma: 90
cell_volume: 257.624
crystal_density: 1.922
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl515034, T = 300 C, P = 0.0 kbar, cell volume = 257.62 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAAAAAAAAAAEAAAAAAAAAAgAAAAAAABAAAAAAACAAAAAACAAAAAAAAAAAAQAAAABAAAAAQAAAAQAAAAgAAACAAAAQAAAAAAACAAACAAAEAAAEAAAIAABAAAEAAAAAAQAAEA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2682
b: 6.2682
c: 6.2682
alpha: 90
beta: 90
gamma: 90
cell_volume: 246.280
crystal_density: 2.011
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57769, T = 300 C, P = 6.7 kbar, cell volume = 246.28 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAIAAAAAAAAABAAAAAAAABAAAAAAACAAAAAABAAAAAAAAAAAAEAAAAAIAAAACAAAABAAAABAAAAEAAAAgAAAAAAACAAABAAABAAACAAAEAAAQAABAAAAAACAA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2084
b: 6.2084
c: 6.2084
alpha: 90
beta: 90
gamma: 90
cell_volume: 239.298
crystal_density: 2.069
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57741, T = 300 C, P = 11.7 kbar, cell volume = 239.30 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAACAAAAAAAAAAEAAAAAAAAEAAAAAAAEAAAAAACAAAAAAAAAAAAEAAAAAQAAAACAAAABAAAABAAAACAAAAQAAAAAAABAAAAgAAAQAAAgAABAAAEAAAQAAAAAAQ==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.1835
b: 6.1835
c: 6.1835
alpha: 90
beta: 90
gamma: 90
cell_volume: 236.430
crystal_density: 2.094
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57709, T = 300 C, P = 16.2 kbar, cell volume = 236.43 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAAAAAAAAAABAAAAAAAAAACAAAAAAAABAAAAAAACAAAAAAAgAAAAAAAAAAABAAAAACAAAAAQAAAAIAAAAIAAAAQAAABAAAAAAAAEAAACAAACAAACAAAEAAAQAABAAAAAAB==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.3884
b: 6.3884
c: 6.3884
alpha: 90
beta: 90
gamma: 90
cell_volume: 260.721
crystal_density: 1.899
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl515035, T = 400 C, P = 0.0 kbar, cell volume = 260.72 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAAAAAAAAAAIAAAAAAAAABAAAAAAAAEAAAAAAAIAAAAAAIAAAAAAAAAAACAAAAAIAAAACAAAACAAAAEAAAAQAAACAAAAAAAAQAAAQAAAgAAAgAACAAAIAABAAAAAAEAAAgA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.3012
b: 6.3012
c: 6.3012
alpha: 90
beta: 90
gamma: 90
cell_volume: 250.190
crystal_density: 1.979
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57789, T = 400 C, P = 6.1 kbar, cell volume = 250.19 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAgAAAAAAAAACAAAAAAAAEAAAAAAAIAAAAAAEAAAAAAAAAAAAgAAAACAAAAAgAAAAQAAAAQAAABAAAAIAAAAAAAAgAAAgAAAgAAAgAACAAAIAABAAAAAABAAA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2796
b: 6.2796
c: 6.2796
alpha: 90
beta: 90
gamma: 90
cell_volume: 247.626
crystal_density: 2.000
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57773, T = 400 C, P = 8.6 kbar, cell volume = 247.63 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAQAAAAAAAAABAAAAAAAACAAAAAAACAAAAAACAAAAAAAAAAAAIAAAAAgAAAAEAAAACAAAAEAAAAQAAABAAAAAAAAEAAAEAAAEAAAEAAAQAABAAAIAAAAAAIAA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2232
b: 6.2232
c: 6.2232
alpha: 90
beta: 90
gamma: 90
cell_volume: 241.013
crystal_density: 2.055
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57737, T = 400 C, P = 13.4 kbar, cell volume = 241.01 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAACAAAAAAAAAAIAAAAAAAAIAAAAAAAIAAAAAAEAAAAAAAAAAAAQAAAAAgAAAAEAAAACAAAACAAAAIAAABAAAAAAAACAAABAAABAAACAAAEAAAQAABAAAAAABA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.1982
b: 6.1982
c: 6.1982
alpha: 90
beta: 90
gamma: 90
cell_volume: 238.121
crystal_density: 2.080
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57713, T = 400 C, P = 16.5 kbar, cell volume = 238.12 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAAAAAAAAAABAAAAAAAAAAEAAAAAAAAEAAAAAAACAAAAAACAAAAAAAAAAAAEAAAAAIAAAABAAAAAgAAAAgAAABAAAAEAAAAAAAAQAAAIAAAIAAAIAAAQAABAAAEAAAAAAE==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.4220
b: 6.4220
c: 6.4220
alpha: 90
beta: 90
gamma: 90
cell_volume: 264.857
crystal_density: 1.870
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl515036, T = 500 C, P = 0.0 kbar, cell volume = 264.86 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAAQAAAAAAAAAEAAAAAAAAQAAAAAABAAAAAABAAAAAAAAAAAAIAAAABAAAAAQAAAAQAAAAgAAAEAAAAgAAAAAAAEAAAEAAAIAAAQAABAAAEAAAgAAAAABAAAgAA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2860
b: 6.2860
c: 6.2860
alpha: 90
beta: 90
gamma: 90
cell_volume: 248.384
crystal_density: 1.994
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57777, T = 500 C, P = 8.9 kbar, cell volume = 248.38 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAQAAAAAAAAACAAAAAAAACAAAAAAAEAAAAAACAAAAAAAAAAAAIAAAAAgAAAAIAAAAEAAAAEAAAAQAAACAAAAAAAAIAAAIAAAIAAAQAAAgAACAAAQAAAAAAIAA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2289
b: 6.2289
c: 6.2289
alpha: 90
beta: 90
gamma: 90
cell_volume: 241.676
crystal_density: 2.049
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57733, T = 500 C, P = 15.0 kbar, cell volume = 241.68 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAAEAAAAAAAAAAQAAAAAAAAIAAAAAAAQAAAAAAIAAAAAAAAAAAAQAAAABAAAAAIAAAAEAAAAEAAAAQAAABAAAAAAAAEAAACAAACAAACAAAIAAAgAACAAAAAACA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2126
b: 6.2126
c: 6.2126
alpha: 90
beta: 90
gamma: 90
cell_volume: 239.784
crystal_density: 2.065
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57717, T = 500 C, P = 17.1 kbar, cell volume = 239.78 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAACAAAAAAAAAAIAAAAAAAAEAAAAAAAIAAAAAAEAAAAAAAAAAAAIAAAAAQAAAAEAAAABAAAABAAAAEAAAAQAAAAAAABAAAAgAAAgAAAgAABAAAEAAAgAAAAAAQ==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.4644
b: 6.4644
c: 6.4644
alpha: 90
beta: 90
gamma: 90
cell_volume: 270.137
crystal_density: 1.833
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl515037, T = 600 C, P = 0.0 kbar, cell volume = 270.14 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAABAAAAAAAAAAQAAAAAAABAAAAAAAEAAAAAAIAAAAAAAAAAACAAAAAQAAAAEAAAAEAAAAQAAABAAAAQAAAAAAACAAACAAAEAAAIAAAgAAEAAAgAAAAACAAAgAAQ==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.3092
b: 6.3092
c: 6.3092
alpha: 90
beta: 90
gamma: 90
cell_volume: 251.144
crystal_density: 1.972
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57781, T = 600 C, P = 9.9 kbar, cell volume = 251.14 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAgAAAAAAAAAEAAAAAAAAIAAAAAAAQAAAAAAIAAAAAAAAAAABAAAAACAAAAAgAAAAQAAAAgAAACAAAAQAAAAAAABAAABAAABAAACAAAEAAAgAACAAAAAACAAA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2341
b: 6.2341
c: 6.2341
alpha: 90
beta: 90
gamma: 90
cell_volume: 242.282
crystal_density: 2.044
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57721, T = 600 C, P = 17.3 kbar, cell volume = 242.28 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAAEAAAAAAAAAAQAAAAAAAAQAAAAAAAQAAAAAAIAAAAAAAAAAAAgAAAABAAAAAQAAAAIAAAAIAAAAQAAACAAAAAAAAIAAAEAAAEAAAEAAAIAABAAAEAAAAAAEA==


formula: K Cl
compound: <missing>
formula_title: <missing>
a: 6.2282
b: 6.2282
c: 6.2282
alpha: 90
beta: 90
gamma: 90
cell_volume: 241.595
crystal_density: 2.050
atoms_sites: ["K", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57725, T = 600 C, P = 17.3 kbar, cell volume = 241.59 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAAEAAAAAAAAAAQAAAAAAAAIAAAAAAAQAAAAAAIAAAAAAAAAAAAQAAAABAAAAAIAAAAEAAAAEAAAAQAAABAAAAAAAAEAAACAAACAAACAAAIAAAgAACAAAAAACA==


formula: (K.9 Na.1) Cl
compound: <missing>
pub_title: Halite-sylvite thermoelasticity Sample: b&w, T = 25 C, P = 0.0 kbar, cell volume = 242.35 ang**3
formula_title: (K.9Na.1)Cl
a: 6.2347
b: 6.2347
c: 6.2347
alpha: 90
beta: 90
gamma: 90
cell_volume: 242.352
crystal_density: 1.999
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gO42AIAaBgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAACAAAAAAAAAAAAAEAAAAAAACAAQAAAAAAAAQAAAAAQAQAAAAAAIAAAAIAAAAAAAgAAAIBAAAAAQAAAQIAAAAIAAAgQAAACAAAgAAAAIAAEEAAAEAAEEAAAIAAhAAAEAAIAAAEA==


formula: (K.9 Na.1) Cl
compound: <missing>
formula_title: (K.9Na.1)Cl
a: 6.3654
b: 6.3654
c: 6.3654
alpha: 90
beta: 90
gamma: 90
cell_volume: 257.915
crystal_density: 1.878
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gO42AIAaBgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als3k90, T = 500 C, P = 0.0 kbar, cell volume = 257.91 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAABAAAAAAAAAAAAAEAAAAAAAEAAgAAAAAAABAAAAACAEAAAAAACAAAAEAAAAAAAgAAAICAAAAAgAABAQAAAAgAAECAAAAQAAIAAAACAACCAAAEAAEIAAAQABBAAAIABAAAAQACEA==


formula: (K.9 Na.1) Cl
compound: <missing>
formula_title: (K.9Na.1)Cl
a: 6.4028
b: 6.4028
c: 6.4028
alpha: 90
beta: 90
gamma: 90
cell_volume: 262.488
crystal_density: 1.846
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gO42AIAaBgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als2k90, T = 600 C, P = 0.0 kbar, cell volume = 262.49 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
pub_title: Halite-sylvite thermoelasticity Sample: b&w, T = 23 C, P = 0.0 kbar, cell volume = 236.48 ang**3
formula_title: (K.8Na.2)Cl
a: 6.1839
b: 6.1839
c: 6.1839
alpha: 90
beta: 90
gamma: 90
cell_volume: 236.476
crystal_density: 2.004
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAABAAAAAAAAAAAAABAAAAAAAAQACAAAAAAAACAAAAABACAAAAAAAgAAAAgAAAAAABAAAAQCAAAAAQAAAgIAAAAIAAAgQAAACAAAgAAAAIAACEAAACAACCAAAEAAIQAABAACAAAB==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.2517
b: 6.2517
c: 6.2517
alpha: 90
beta: 90
gamma: 90
cell_volume: 244.340
crystal_density: 1.939
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als11k80, T = 300 C, P = 0.0 kbar, cell volume = 244.34 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAEAAAAAAAAAAAAAIAAAAAAAEAAgAAAAAAAAgAAAAAgAgAAAAAAgAAAAgAAAAAACAAAAQEAAAAAgAABAQAAAAgAACBAAAAIAACAAAAAgAAQQAAAQAAggAABAACEAAAQABAAAAgA==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.2100
b: 6.2100
c: 6.2100
alpha: 90
beta: 90
gamma: 90
cell_volume: 239.483
crystal_density: 1.978
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55633, T = 300 C, P = 3.6 kbar, cell volume = 239.48 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAACAAAAAAAAAAAAACAAAAAAAAgAEAAAAAAAAEAAAAAEAIAAAAAACAAAACAAAAAAAIAAACAQAAAACAAAEBAAAABAAAECAAAAQAAEAAAABAAAggAAAQAAQgAABAACEAAAQABAAAAQ==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.2644
b: 6.2644
c: 6.2644
alpha: 90
beta: 90
gamma: 90
cell_volume: 245.832
crystal_density: 1.927
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als10k80, T = 350 C, P = 0.0 kbar, cell volume = 245.83 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAEAAAAAAAAAAAAAIAAAAAAAEABAAAAAAAABAAAAABACAAAAAABAAAABAAAAAAAEAAABAIAAAACAAACBAAAABAAAIEAAAAgAAIAAAACAABBAAABAABCAAAEAAIIAABAAEAAABAA==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.0760
b: 6.0760
c: 6.0760
alpha: 90
beta: 90
gamma: 90
cell_volume: 224.312
crystal_density: 2.112
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55501, T = 350 C, P = 17.2 kbar, cell volume = 224.31 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAEAAAAAAAAAAAAABAAAAAAAAQACAAAAAAAAAgAAAAAQAgAAAAAAEAAAAEAAAAAAAEAAAAgIAAAAAgAAAgIAAAAIAAAQIAAAAgAAIAAAABAAAgQAAAQAAQIAAAQAAggAACAAEA==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.2780
b: 6.2780
c: 6.2780
alpha: 90
beta: 90
gamma: 90
cell_volume: 247.437
crystal_density: 1.915
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als9k80, T = 400 C, P = 0.0 kbar, cell volume = 247.44 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAIAAAAAAAAAAAAAQAAAAAAAIABAAAAAAAACAAAAACACAAAAAACAAAACAAAAAAAIAAACAgAAAAEAAAICAAAAEAAAQIAAABAAAQAAAAEAACEAAAEAAIEAAAQAAhAAAEAAQAAAIAA==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.2169
b: 6.2169
c: 6.2169
alpha: 90
beta: 90
gamma: 90
cell_volume: 240.282
crystal_density: 1.972
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55629, T = 400 C, P = 5.2 kbar, cell volume = 240.28 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAACAAAAAAAAAAAAACAAAAAAABAAIAAAAAAAAIAAAAAEAIAAAAAAEAAAAEAAAAAAAIAAACAgAAAAEAAAECAAAACAAAIEAAAAgAAIAAAABAABAgAAAgABBAAACAAEEAAAgACAAAAQ==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.0757
b: 6.0757
c: 6.0757
alpha: 90
beta: 90
gamma: 90
cell_volume: 224.279
crystal_density: 2.112
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55493, T = 450 C, P = 19.0 kbar, cell volume = 224.28 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAEAAAAAAAAAAAAABAAAAAAAAQACAAAAAAAAAgAAAAAQAgAAAAAAEAAAAEAAAAAAAEAAAAgIAAAAAgAAAgIAAAAIAAAQIAAAAgAAEAAAABAAAQQAAAQAAQIAAAQAAggAACAAEA==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1674
b: 6.1674
c: 6.1674
alpha: 90
beta: 90
gamma: 90
cell_volume: 234.588
crystal_density: 2.020
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53261, T = 475 C, P = 12.1 kbar, cell volume = 234.59 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAgAAAAAAAAAAAAAgAAAAAAAIABAAAAAAAABAAAAAAgBAAAAAAAQAAAAQAAAAAAAgAAAEBAAAAAIAAAICAAAACAAAIEAAAAgAAIAAAABAAAggAAAQAAggAABAACCAAAQAAgAAA==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.3108
b: 6.3108
c: 6.3108
alpha: 90
beta: 90
gamma: 90
cell_volume: 251.335
crystal_density: 1.885
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als7k80, T = 500 C, P = 0.0 kbar, cell volume = 251.33 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAQAAAAAAAAAAAAAgAAAAAAAgAEAAAAAAAAIAAAAAIAQAAAAAAIAAAAQAAAAAABAAAAQEAAAAAgAABAQAAAAgAAECAAAAQAAEAAAACAABBAAABAACCAAAEAAQgAACAAIAAACAAR==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.2263
b: 6.2263
c: 6.2263
alpha: 90
beta: 90
gamma: 90
cell_volume: 241.374
crystal_density: 1.963
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55617, T = 500 C, P = 7.0 kbar, cell volume = 241.37 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAACAAAAAAAAAAAAAEAAAAAAABAAIAAAAAAAAIAAAAAIAQAAAAAAEAAAAIAAAAAAAQAAAEBAAAAAIAAAICAAAAEAAAQIAAABAAAQAAAAEAACCAAACAACCAAAIAAIQAABAAIAAABA==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1884
b: 6.1884
c: 6.1884
alpha: 90
beta: 90
gamma: 90
cell_volume: 236.993
crystal_density: 1.999
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55577, T = 500 C, P = 9.6 kbar, cell volume = 236.99 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAABAAAAAAAAAAAAABAAAAAAAAQACAAAAAAAACAAAAABACAAAAAABAAAAAgAAAAAACAAAAQEAAAAAgAAAgQAAAAIAABAgAAACAAAgAAAAIAAEEAAACAAEEAAAIAAQgAACAAEAAAB==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1696
b: 6.1696
c: 6.1696
alpha: 90
beta: 90
gamma: 90
cell_volume: 234.839
crystal_density: 2.017
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53253, T = 500 C, P = 12.3 kbar, cell volume = 234.84 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAgAAAAAAAAAAAAAgAAAAAAAIABAAAAAAAABAAAAAAgBAAAAAAAQAAAAQAAAAAAAgAAAIBAAAAAIAAAIEAAAAEAAAQIAAAAgAAIAAAABAAAggAAAgAAhAAABAACCAAAQAAgAAA==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1321
b: 6.1321
c: 6.1321
alpha: 90
beta: 90
gamma: 90
cell_volume: 230.583
crystal_density: 2.055
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55377, T = 500 C, P = 15.0 kbar, cell volume = 230.58 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAQAAAAAAAAAAAAAIAAAAAAACAAQAAAAAAAAIAAAAAIAIAAAAAACAAAACAAAAAAACAAAAgEAAAAAgAAAgIAAAAIAAAgQAAABAAAQAAAACAABBAAAAgABBAAACAACEAAAQABAAA==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1188
b: 6.1188
c: 6.1188
alpha: 90
beta: 90
gamma: 90
cell_volume: 229.086
crystal_density: 2.068
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53197, T = 500 C, P = 18.0 kbar, cell volume = 229.09 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAQAAAAAAAAAAAAAIAAAAAAABAAIAAAAAAAAEAAAAACAEAAAAAABAAAAAgAAAAAABAAAAQCAAAAAIAAAQEAAAAEAAAQEAAAAgAAEAAAAAgAAQQAAAQAAQQAAAQABBAAAEAAIAA==


formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.3272
b: 6.3272
c: 6.3272
alpha: 90
beta: 90
gamma: 90
cell_volume: 253.300
crystal_density: 1.870
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als6k80, T = 550 C, P = 0.0 kbar, cell volume = 253.30 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1999
b: 6.1999
c: 6.1999
alpha: 90
beta: 90
gamma: 90
cell_volume: 238.316
crystal_density: 1.988
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55589, T = 550 C, P = 10.1 kbar, cell volume = 238.32 ang**3

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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1709
b: 6.1709
c: 6.1709
alpha: 90
beta: 90
gamma: 90
cell_volume: 234.988
crystal_density: 2.016
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
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atoms_occupancy: ANQwAAA1DAAACT0A
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53249, T = 550 C, P = 13.3 kbar, cell volume = 234.99 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1348
b: 6.1348
c: 6.1348
alpha: 90
beta: 90
gamma: 90
cell_volume: 230.888
crystal_density: 2.052
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55373, T = 550 C, P = 16.0 kbar, cell volume = 230.89 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1224
b: 6.1224
c: 6.1224
alpha: 90
beta: 90
gamma: 90
cell_volume: 229.491
crystal_density: 2.064
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53201, T = 550 C, P = 18.1 kbar, cell volume = 229.49 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.3484
b: 6.3484
c: 6.3484
alpha: 90
beta: 90
gamma: 90
cell_volume: 255.854
crystal_density: 1.852
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: als5k80, T = 600 C, P = 0.0 kbar, cell volume = 255.85 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.2049
b: 6.2049
c: 6.2049
alpha: 90
beta: 90
gamma: 90
cell_volume: 238.893
crystal_density: 1.983
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55593, T = 600 C, P = 7.5 kbar, cell volume = 238.89 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.2268
b: 6.2268
c: 6.2268
alpha: 90
beta: 90
gamma: 90
cell_volume: 241.432
crystal_density: 1.962
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55613, T = 600 C, P = 7.5 kbar, cell volume = 241.43 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1756
b: 6.1756
c: 6.1756
alpha: 90
beta: 90
gamma: 90
cell_volume: 235.525
crystal_density: 2.012
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53237, T = 600 C, P = 14.0 kbar, cell volume = 235.53 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1371
b: 6.1371
c: 6.1371
alpha: 90
beta: 90
gamma: 90
cell_volume: 231.148
crystal_density: 2.050
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55369, T = 600 C, P = 17.0 kbar, cell volume = 231.15 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1300
b: 6.1300
c: 6.1300
alpha: 90
beta: 90
gamma: 90
cell_volume: 230.346
crystal_density: 2.057
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53205, T = 600 C, P = 18.1 kbar, cell volume = 230.35 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.3651
b: 6.3651
c: 6.3651
alpha: 90
beta: 90
gamma: 90
cell_volume: 257.879
crystal_density: 1.837
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als3k80, T = 650 C, P = 0.0 kbar, cell volume = 257.88 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.3714
b: 6.3714
c: 6.3714
alpha: 90
beta: 90
gamma: 90
cell_volume: 258.645
crystal_density: 1.832
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: als4k80, T = 650 C, P = 0.0 kbar, cell volume = 258.64 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.2170
b: 6.2170
c: 6.2170
alpha: 90
beta: 90
gamma: 90
cell_volume: 240.294
crystal_density: 1.972
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55597, T = 650 C, P = 7.7 kbar, cell volume = 240.29 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1804
b: 6.1804
c: 6.1804
alpha: 90
beta: 90
gamma: 90
cell_volume: 236.075
crystal_density: 2.007
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53233, T = 650 C, P = 14.6 kbar, cell volume = 236.07 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1441
b: 6.1441
c: 6.1441
alpha: 90
beta: 90
gamma: 90
cell_volume: 231.940
crystal_density: 2.043
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53217, T = 650 C, P = 18.6 kbar, cell volume = 231.94 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.2264
b: 6.2264
c: 6.2264
alpha: 90
beta: 90
gamma: 90
cell_volume: 241.385
crystal_density: 1.963
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55601, T = 700 C, P = 8.0 kbar, cell volume = 241.39 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1781
b: 6.1781
c: 6.1781
alpha: 90
beta: 90
gamma: 90
cell_volume: 235.811
crystal_density: 2.009
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u13: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53221, T = 700 C, P = 15.6 kbar, cell volume = 235.81 ang**3

qdat:
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formula: (K.8 Na.2) Cl
compound: <missing>
formula_title: (K.8Na.2)Cl
a: 6.1421
b: 6.1421
c: 6.1421
alpha: 90
beta: 90
gamma: 90
cell_volume: 231.713
crystal_density: 2.045
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ANQwAAA1DAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r55365, T = 700 C, P = 19.0 kbar, cell volume = 231.71 ang**3

qdat:
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formula: (K.7 Na.3) Cl
compound: <missing>
pub_title: Halite-sylvite thermoelasticity Sample: b&w, T = 25 C, P = 0.0 kbar, cell volume = 228.78 ang**3
formula_title: (K.7Na.3)Cl
a: 6.1161
b: 6.1161
c: 6.1161
alpha: 90
beta: 90
gamma: 90
cell_volume: 228.783
crystal_density: 2.024
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gLkqAIBPEgAACT0A
atoms_u_iso: 0
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atoms_aniso_u13: 0
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qdat:
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formula: (K.7 Na.3) Cl
compound: <missing>
formula_title: (K.7Na.3)Cl
a: 6.2559
b: 6.2559
c: 6.2559
alpha: 90
beta: 90
gamma: 90
cell_volume: 244.833
crystal_density: 1.891
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gLkqAIBPEgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als4k70, T = 500 C, P = 0.0 kbar, cell volume = 244.83 ang**3

qdat:
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formula: (K.7 Na.3) Cl
compound: <missing>
formula_title: (K.7Na.3)Cl
a: 6.2763
b: 6.2763
c: 6.2763
alpha: 90
beta: 90
gamma: 90
cell_volume: 247.236
crystal_density: 1.873
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gLkqAIBPEgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: als3k70, T = 550 C, P = 0.0 kbar, cell volume = 247.23 ang**3

qdat:
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formula: (K.7 Na.3) Cl
compound: <missing>
formula_title: (K.7Na.3)Cl
a: 6.2962
b: 6.2962
c: 6.2962
alpha: 90
beta: 90
gamma: 90
cell_volume: 249.595
crystal_density: 1.855
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gLkqAIBPEgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als2k70, T = 600 C, P = 0.0 kbar, cell volume = 249.59 ang**3

qdat:
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formula: (K.7 Na.3) Cl
compound: <missing>
formula_title: (K.7Na.3)Cl
a: 6.3194
b: 6.3194
c: 6.3194
alpha: 90
beta: 90
gamma: 90
cell_volume: 252.364
crystal_density: 1.835
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gLkqAIBPEgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als1k70, T = 650 C, P = 0.0 kbar, cell volume = 252.36 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
pub_title: Halite-sylvite thermoelasticity Sample: b&w, T = 25 C, P = 0.0 kbar, cell volume = 221.90 ang**3
formula_title: (K.6Na.4)Cl
a: 6.0541
b: 6.0541
c: 6.0541
alpha: 90
beta: 90
gamma: 90
cell_volume: 221.896
crystal_density: 2.039
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0023
b: 6.0023
c: 6.0023
alpha: 90
beta: 90
gamma: 90
cell_volume: 216.248
crystal_density: 2.092
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54811, T = 400 C, P = 15.0 kbar, cell volume = 216.25 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0684
b: 6.0684
c: 6.0684
alpha: 90
beta: 90
gamma: 90
cell_volume: 223.472
crystal_density: 2.024
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54935, T = 450 C, P = 8.8 kbar, cell volume = 223.47 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0690
b: 6.0690
c: 6.0690
alpha: 90
beta: 90
gamma: 90
cell_volume: 223.538
crystal_density: 2.024
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54883, T = 450 C, P = 8.9 kbar, cell volume = 223.54 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0041
b: 6.0041
c: 6.0041
alpha: 90
beta: 90
gamma: 90
cell_volume: 216.443
crystal_density: 2.090
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54807, T = 450 C, P = 15.7 kbar, cell volume = 216.44 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.1957
b: 6.1957
c: 6.1957
alpha: 90
beta: 90
gamma: 90
cell_volume: 237.832
crystal_density: 1.902
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als13k60, T = 500 C, P = 0.0 kbar, cell volume = 237.83 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0687
b: 6.0687
c: 6.0687
alpha: 90
beta: 90
gamma: 90
cell_volume: 223.505
crystal_density: 2.024
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54907, T = 500 C, P = 9.8 kbar, cell volume = 223.50 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0731
b: 6.0731
c: 6.0731
alpha: 90
beta: 90
gamma: 90
cell_volume: 223.991
crystal_density: 2.020
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54927, T = 500 C, P = 9.8 kbar, cell volume = 223.99 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0724
b: 6.0724
c: 6.0724
alpha: 90
beta: 90
gamma: 90
cell_volume: 223.914
crystal_density: 2.020
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54879, T = 500 C, P = 10.1 kbar, cell volume = 223.91 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAEAAAAAAAAAAAAABAAAAAAAAQACAAAAAAAAAgAAAAAQAQAAAAAAEAAAAEAAAAAAAEAAAAgEAAAAAgAAAQIAAAAEAAAQIAAAAgAAEAAAAAgAAQQAAAIAAIIAAAIAAQgAACAAEA==


formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0448
b: 6.0448
c: 6.0448
alpha: 90
beta: 90
gamma: 90
cell_volume: 220.875
crystal_density: 2.048
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r52113, T = 500 C, P = 11.9 kbar, cell volume = 220.87 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAACAAAAAAAAAAAAAAgAAAAAAAEAAgAAAAAAAAIAAAAAEAEAAAAAABAAAAAgAAAAAAAgAAAEAgAAAAEAAACBAAAAAgAACAgAAACAAAgAAAAEAABBAAAAgAAggAAAgABCAAAEAAQ==


formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0066
b: 6.0066
c: 6.0066
alpha: 90
beta: 90
gamma: 90
cell_volume: 216.714
crystal_density: 2.087
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54803, T = 500 C, P = 16.5 kbar, cell volume = 216.71 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAABAAAAAAAAAAAAAAIAAAAAAABAAIAAAAAAAACAAAAAAgAgAAAAAAIAAAAEAAAAAAACAAAAQCAAAAAIAAAICAAAABAAAECAAAAEAABAAAAAEAACCAAABAAAggAAAgABBAAAEAA==


formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.2160
b: 6.2160
c: 6.2160
alpha: 90
beta: 90
gamma: 90
cell_volume: 240.178
crystal_density: 1.884
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als12k60, T = 550 C, P = 0.0 kbar, cell volume = 240.18 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0785
b: 6.0785
c: 6.0785
alpha: 90
beta: 90
gamma: 90
cell_volume: 224.589
crystal_density: 2.014
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54875, T = 550 C, P = 11.2 kbar, cell volume = 224.59 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0483
b: 6.0483
c: 6.0483
alpha: 90
beta: 90
gamma: 90
cell_volume: 221.258
crystal_density: 2.045
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r52105, T = 550 C, P = 12.6 kbar, cell volume = 221.26 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0081
b: 6.0081
c: 6.0081
alpha: 90
beta: 90
gamma: 90
cell_volume: 216.876
crystal_density: 2.086
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54795, T = 550 C, P = 17.3 kbar, cell volume = 216.88 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.2395
b: 6.2395
c: 6.2395
alpha: 90
beta: 90
gamma: 90
cell_volume: 242.912
crystal_density: 1.862
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als11k60, T = 600 C, P = 0.0 kbar, cell volume = 242.91 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAEAAAAAAAAAAAAAEAAAAAAACAAQAAAAAAAAQAAAAAQAgAAAAAAQAAAAQAAAAAAAgAAAICAAAAAQAAAgIAAAAIAABAgAAACAABAAAAAQAAIIAAAEAAIIAAAQABBAAAEAAQAAAEA==


formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.2339
b: 6.2339
c: 6.2339
alpha: 90
beta: 90
gamma: 90
cell_volume: 242.259
crystal_density: 1.867
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als5k60, T = 600 C, P = 0.0 kbar, cell volume = 242.26 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.2355
b: 6.2355
c: 6.2355
alpha: 90
beta: 90
gamma: 90
cell_volume: 242.445
crystal_density: 1.866
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als6k60, T = 600 C, P = 0.0 kbar, cell volume = 242.45 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0747
b: 6.0747
c: 6.0747
alpha: 90
beta: 90
gamma: 90
cell_volume: 224.168
crystal_density: 2.018
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54911, T = 600 C, P = 11.5 kbar, cell volume = 224.17 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0691
b: 6.0691
c: 6.0691
alpha: 90
beta: 90
gamma: 90
cell_volume: 223.549
crystal_density: 2.024
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54863, T = 600 C, P = 12.4 kbar, cell volume = 223.55 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0385
b: 6.0385
c: 6.0385
alpha: 90
beta: 90
gamma: 90
cell_volume: 220.185
crystal_density: 2.055
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
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atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r52081, T = 600 C, P = 15.4 kbar, cell volume = 220.18 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0050
b: 6.0050
c: 6.0050
alpha: 90
beta: 90
gamma: 90
cell_volume: 216.540
crystal_density: 2.089
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
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atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54827, T = 600 C, P = 18.8 kbar, cell volume = 216.54 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.2601
b: 6.2601
c: 6.2601
alpha: 90
beta: 90
gamma: 90
cell_volume: 245.326
crystal_density: 1.844
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: als9k60, T = 650 C, P = 0.0 kbar, cell volume = 245.33 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.2600
b: 6.2600
c: 6.2600
alpha: 90
beta: 90
gamma: 90
cell_volume: 245.314
crystal_density: 1.844
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
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atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: als7k60, T = 650 C, P = 0.0 kbar, cell volume = 245.31 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.2595
b: 6.2595
c: 6.2595
alpha: 90
beta: 90
gamma: 90
cell_volume: 245.256
crystal_density: 1.845
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
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atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: als8k60, T = 650 C, P = 0.0 kbar, cell volume = 245.25 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.2626
b: 6.2626
c: 6.2626
alpha: 90
beta: 90
gamma: 90
cell_volume: 245.620
crystal_density: 1.842
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: als10k60, T = 650 C, P = 0.0 kbar, cell volume = 245.62 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0717
b: 6.0717
c: 6.0717
alpha: 90
beta: 90
gamma: 90
cell_volume: 223.837
crystal_density: 2.021
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
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atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54867, T = 650 C, P = 12.4 kbar, cell volume = 223.84 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0427
b: 6.0427
c: 6.0427
alpha: 90
beta: 90
gamma: 90
cell_volume: 220.644
crystal_density: 2.050
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
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atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r52085, T = 650 C, P = 15.1 kbar, cell volume = 220.64 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0042
b: 6.0042
c: 6.0042
alpha: 90
beta: 90
gamma: 90
cell_volume: 216.454
crystal_density: 2.090
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54835, T = 650 C, P = 19.6 kbar, cell volume = 216.45 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0062
b: 6.0062
c: 6.0062
alpha: 90
beta: 90
gamma: 90
cell_volume: 216.670
crystal_density: 2.088
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54783, T = 650 C, P = 19.6 kbar, cell volume = 216.67 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0873
b: 6.0873
c: 6.0873
alpha: 90
beta: 90
gamma: 90
cell_volume: 225.566
crystal_density: 2.006
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54871, T = 700 C, P = 12.4 kbar, cell volume = 225.57 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0574
b: 6.0574
c: 6.0574
alpha: 90
beta: 90
gamma: 90
cell_volume: 222.259
crystal_density: 2.035
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r52097, T = 700 C, P = 15.3 kbar, cell volume = 222.26 ang**3

qdat:
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formula: (K.6 Na.4) Cl
compound: <missing>
formula_title: (K.6Na.4)Cl
a: 6.0134
b: 6.0134
c: 6.0134
alpha: 90
beta: 90
gamma: 90
cell_volume: 217.450
crystal_density: 2.080
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AJ8kAABqGAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54787, T = 700 C, P = 19.7 kbar, cell volume = 217.45 ang**3

qdat:
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formula: (K.5 Na.5) Cl
compound: <missing>
pub_title: Halite-sylvite thermoelasticity Sample: b&w, T = 25 C, P = 0.0 kbar, cell volume = 214.96 ang**3
formula_title: (K.5Na.5)Cl
a: 5.9904
b: 5.9904
c: 5.9904
alpha: 90
beta: 90
gamma: 90
cell_volume: 214.965
crystal_density: 2.055
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gIQeAICEHgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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qdat:
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formula: (K.5 Na.5) Cl
compound: <missing>
formula_title: (K.5Na.5)Cl
a: 6.1262
b: 6.1262
c: 6.1262
alpha: 90
beta: 90
gamma: 90
cell_volume: 229.918
crystal_density: 1.921
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gIQeAICEHgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als4k50, T = 500 C, P = 0.0 kbar, cell volume = 229.92 ang**3

qdat:
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formula: (K.5 Na.5) Cl
compound: <missing>
formula_title: (K.5Na.5)Cl
a: 6.1449
b: 6.1449
c: 6.1449
alpha: 90
beta: 90
gamma: 90
cell_volume: 232.030
crystal_density: 1.904
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gIQeAICEHgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als3k50, T = 550 C, P = 0.0 kbar, cell volume = 232.03 ang**3

qdat:
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formula: (K.5 Na.5) Cl
compound: <missing>
formula_title: (K.5Na.5)Cl
a: 6.1660
b: 6.1660
c: 6.1660
alpha: 90
beta: 90
gamma: 90
cell_volume: 234.429
crystal_density: 1.884
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gIQeAICEHgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als2k50, T = 600 C, P = 0.0 kbar, cell volume = 234.43 ang**3

qdat:
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formula: (K.5 Na.5) Cl
compound: <missing>
formula_title: (K.5Na.5)Cl
a: 6.1899
b: 6.1899
c: 6.1899
alpha: 90
beta: 90
gamma: 90
cell_volume: 237.165
crystal_density: 1.862
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gIQeAICEHgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als1k50, T = 650 C, P = 0.0 kbar, cell volume = 237.16 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
pub_title: Halite-sylvite thermoelasticity Sample: b&w, T = 25 C, P = 0.0 kbar, cell volume = 207.96 ang**3
formula_title: (K.4Na.6)Cl
a: 5.9246
b: 5.9246
c: 5.9246
alpha: 90
beta: 90
gamma: 90
cell_volume: 207.959
crystal_density: 2.072
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
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qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8498
b: 5.8498
c: 5.8498
alpha: 90
beta: 90
gamma: 90
cell_volume: 200.181
crystal_density: 2.153
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54490, T = 400 C, P = 16.9 kbar, cell volume = 200.18 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9672
b: 5.9672
c: 5.9672
alpha: 90
beta: 90
gamma: 90
cell_volume: 212.477
crystal_density: 2.028
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57084, T = 450 C, P = 7.6 kbar, cell volume = 212.48 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8838
b: 5.8838
c: 5.8838
alpha: 90
beta: 90
gamma: 90
cell_volume: 203.692
crystal_density: 2.116
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57152, T = 450 C, P = 15.9 kbar, cell volume = 203.69 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8475
b: 5.8475
c: 5.8475
alpha: 90
beta: 90
gamma: 90
cell_volume: 199.945
crystal_density: 2.156
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57212, T = 450 C, P = 20.6 kbar, cell volume = 199.95 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 6.0623
b: 6.0623
c: 6.0623
alpha: 90
beta: 90
gamma: 90
cell_volume: 222.799
crystal_density: 1.934
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als6k40, T = 500 C, P = 0.0 kbar, cell volume = 222.80 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9715
b: 5.9715
c: 5.9715
alpha: 90
beta: 90
gamma: 90
cell_volume: 212.937
crystal_density: 2.024
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57080, T = 500 C, P = 8.6 kbar, cell volume = 212.94 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9084
b: 5.9084
c: 5.9084
alpha: 90
beta: 90
gamma: 90
cell_volume: 206.257
crystal_density: 2.090
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54394, T = 500 C, P = 12.2 kbar, cell volume = 206.26 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8863
b: 5.8863
c: 5.8863
alpha: 90
beta: 90
gamma: 90
cell_volume: 203.952
crystal_density: 2.113
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57148, T = 500 C, P = 16.9 kbar, cell volume = 203.95 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8553
b: 5.8553
c: 5.8553
alpha: 90
beta: 90
gamma: 90
cell_volume: 200.746
crystal_density: 2.147
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54486, T = 500 C, P = 18.6 kbar, cell volume = 200.75 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 6.0833
b: 6.0833
c: 6.0833
alpha: 90
beta: 90
gamma: 90
cell_volume: 225.122
crystal_density: 1.914
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als5k40, T = 550 C, P = 0.0 kbar, cell volume = 225.12 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9778
b: 5.9778
c: 5.9778
alpha: 90
beta: 90
gamma: 90
cell_volume: 213.611
crystal_density: 2.018
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57076, T = 550 C, P = 9.6 kbar, cell volume = 213.61 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9123
b: 5.9123
c: 5.9123
alpha: 90
beta: 90
gamma: 90
cell_volume: 206.666
crystal_density: 2.085
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54390, T = 550 C, P = 13.2 kbar, cell volume = 206.67 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8884
b: 5.8884
c: 5.8884
alpha: 90
beta: 90
gamma: 90
cell_volume: 204.170
crystal_density: 2.111
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57144, T = 550 C, P = 17.8 kbar, cell volume = 204.17 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8515
b: 5.8515
c: 5.8515
alpha: 90
beta: 90
gamma: 90
cell_volume: 200.356
crystal_density: 2.151
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57204, T = 550 C, P = 22.9 kbar, cell volume = 200.36 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 6.1046
b: 6.1046
c: 6.1046
alpha: 90
beta: 90
gamma: 90
cell_volume: 227.495
crystal_density: 1.894
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als4k40, T = 600 C, P = 0.0 kbar, cell volume = 227.50 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9146
b: 5.9146
c: 5.9146
alpha: 90
beta: 90
gamma: 90
cell_volume: 206.907
crystal_density: 2.083
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54382, T = 600 C, P = 14.1 kbar, cell volume = 206.91 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9121
b: 5.9121
c: 5.9121
alpha: 90
beta: 90
gamma: 90
cell_volume: 206.645
crystal_density: 2.086
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54414, T = 600 C, P = 14.1 kbar, cell volume = 206.65 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9108
b: 5.9108
c: 5.9108
alpha: 90
beta: 90
gamma: 90
cell_volume: 206.509
crystal_density: 2.087
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54426, T = 600 C, P = 14.1 kbar, cell volume = 206.51 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8823
b: 5.8823
c: 5.8823
alpha: 90
beta: 90
gamma: 90
cell_volume: 203.536
crystal_density: 2.117
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53017, T = 600 C, P = 18.4 kbar, cell volume = 203.54 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8598
b: 5.8598
c: 5.8598
alpha: 90
beta: 90
gamma: 90
cell_volume: 201.209
crystal_density: 2.142
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54482, T = 600 C, P = 20.4 kbar, cell volume = 201.21 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8478
b: 5.8478
c: 5.8478
alpha: 90
beta: 90
gamma: 90
cell_volume: 199.976
crystal_density: 2.155
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54470, T = 600 C, P = 21.2 kbar, cell volume = 199.98 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8843
b: 5.8843
c: 5.8843
alpha: 90
beta: 90
gamma: 90
cell_volume: 203.744
crystal_density: 2.115
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53021, T = 625 C, P = 18.3 kbar, cell volume = 203.74 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 6.1264
b: 6.1264
c: 6.1264
alpha: 90
beta: 90
gamma: 90
cell_volume: 229.941
crystal_density: 1.874
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als3k40, T = 650 C, P = 0.0 kbar, cell volume = 229.94 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9911
b: 5.9911
c: 5.9911
alpha: 90
beta: 90
gamma: 90
cell_volume: 215.040
crystal_density: 2.004
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57068, T = 650 C, P = 11.5 kbar, cell volume = 215.04 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9123
b: 5.9123
c: 5.9123
alpha: 90
beta: 90
gamma: 90
cell_volume: 206.666
crystal_density: 2.085
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54366, T = 650 C, P = 15.9 kbar, cell volume = 206.67 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8919
b: 5.8919
c: 5.8919
alpha: 90
beta: 90
gamma: 90
cell_volume: 204.534
crystal_density: 2.107
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53025, T = 650 C, P = 18.2 kbar, cell volume = 204.53 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8989
b: 5.8989
c: 5.8989
alpha: 90
beta: 90
gamma: 90
cell_volume: 205.264
crystal_density: 2.100
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
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atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57136, T = 650 C, P = 19.6 kbar, cell volume = 205.26 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8552
b: 5.8552
c: 5.8552
alpha: 90
beta: 90
gamma: 90
cell_volume: 200.736
crystal_density: 2.147
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57196, T = 650 C, P = 25.2 kbar, cell volume = 200.74 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8954
b: 5.8954
c: 5.8954
alpha: 90
beta: 90
gamma: 90
cell_volume: 204.899
crystal_density: 2.103
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53029, T = 675 C, P = 18.1 kbar, cell volume = 204.90 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9961
b: 5.9961
c: 5.9961
alpha: 90
beta: 90
gamma: 90
cell_volume: 215.579
crystal_density: 1.999
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57064, T = 700 C, P = 12.5 kbar, cell volume = 215.58 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9237
b: 5.9237
c: 5.9237
alpha: 90
beta: 90
gamma: 90
cell_volume: 207.864
crystal_density: 2.073
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54370, T = 700 C, P = 16.0 kbar, cell volume = 207.86 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9237
b: 5.9237
c: 5.9237
alpha: 90
beta: 90
gamma: 90
cell_volume: 207.864
crystal_density: 2.073
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53053, T = 700 C, P = 16.3 kbar, cell volume = 207.86 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9111
b: 5.9111
c: 5.9111
alpha: 90
beta: 90
gamma: 90
cell_volume: 206.540
crystal_density: 2.087
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53041, T = 700 C, P = 18.0 kbar, cell volume = 206.54 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8999
b: 5.8999
c: 5.8999
alpha: 90
beta: 90
gamma: 90
cell_volume: 205.369
crystal_density: 2.099
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
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atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57132, T = 700 C, P = 20.6 kbar, cell volume = 205.37 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8655
b: 5.8655
c: 5.8655
alpha: 90
beta: 90
gamma: 90
cell_volume: 201.797
crystal_density: 2.136
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r54474, T = 700 C, P = 22.1 kbar, cell volume = 201.80 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.8566
b: 5.8566
c: 5.8566
alpha: 90
beta: 90
gamma: 90
cell_volume: 200.880
crystal_density: 2.145
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r57240, T = 700 C, P = 26.0 kbar, cell volume = 200.88 ang**3

qdat:
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formula: (K.4 Na.6) Cl
compound: <missing>
formula_title: (K.4Na.6)Cl
a: 5.9236
b: 5.9236
c: 5.9236
alpha: 90
beta: 90
gamma: 90
cell_volume: 207.853
crystal_density: 2.073
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: AGoYAACfJAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53049, T = 750 C, P = 17.2 kbar, cell volume = 207.85 ang**3

qdat:
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formula: (K.3 Na.7) Cl
compound: <missing>
pub_title: Halite-sylvite thermoelasticity Sample: b&w, T = 25 C, P = 0.0 kbar, cell volume = 200.90 ang**3
formula_title: (K.3Na.7)Cl
a: 5.8568
b: 5.8568
c: 5.8568
alpha: 90
beta: 90
gamma: 90
cell_volume: 200.901
crystal_density: 2.092
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gE8SAIC5KgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
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formula: (K.3 Na.7) Cl
compound: <missing>
formula_title: (K.3Na.7)Cl
a: 5.9915
b: 5.9915
c: 5.9915
alpha: 90
beta: 90
gamma: 90
cell_volume: 215.083
crystal_density: 1.954
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gE8SAIC5KgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als6k30, T = 508 C, P = 0.0 kbar, cell volume = 215.08 ang**3

qdat:
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formula: (K.3 Na.7) Cl
compound: <missing>
formula_title: (K.3Na.7)Cl
a: 6.0103
b: 6.0103
c: 6.0103
alpha: 90
beta: 90
gamma: 90
cell_volume: 217.114
crystal_density: 1.936
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gE8SAIC5KgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als5k30, T = 550 C, P = 0.0 kbar, cell volume = 217.11 ang**3

qdat:
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formula: (K.3 Na.7) Cl
compound: <missing>
formula_title: (K.3Na.7)Cl
a: 6.0310
b: 6.0310
c: 6.0310
alpha: 90
beta: 90
gamma: 90
cell_volume: 219.365
crystal_density: 1.916
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gE8SAIC5KgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als4k30, T = 600 C, P = 0.0 kbar, cell volume = 219.37 ang**3

qdat:
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formula: (K.3 Na.7) Cl
compound: <missing>
formula_title: (K.3Na.7)Cl
a: 6.0524
b: 6.0524
c: 6.0524
alpha: 90
beta: 90
gamma: 90
cell_volume: 221.709
crystal_density: 1.896
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gE8SAIC5KgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als3k30, T = 650 C, P = 0.0 kbar, cell volume = 221.71 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
pub_title: Halite-sylvite thermoelasticity Sample: b&w, T = 25 C, P = 0.0 kbar, cell volume = 193.78 ang**3
formula_title: (K.2Na.8)Cl
a: 5.7868
b: 5.7868
c: 5.7868
alpha: 90
beta: 90
gamma: 90
cell_volume: 193.783
crystal_density: 2.114
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7630
b: 5.7630
c: 5.7630
alpha: 90
beta: 90
gamma: 90
cell_volume: 191.402
crystal_density: 2.140
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56329, T = 350 C, P = 11.8 kbar, cell volume = 191.40 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7615
b: 5.7615
c: 5.7615
alpha: 90
beta: 90
gamma: 90
cell_volume: 191.252
crystal_density: 2.142
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56361, T = 350 C, P = 12.4 kbar, cell volume = 191.25 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.6958
b: 5.6958
c: 5.6958
alpha: 90
beta: 90
gamma: 90
cell_volume: 184.784
crystal_density: 2.217
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56417, T = 350 C, P = 21.0 kbar, cell volume = 184.78 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7676
b: 5.7676
c: 5.7676
alpha: 90
beta: 90
gamma: 90
cell_volume: 191.860
crystal_density: 2.135
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56325, T = 400 C, P = 12.6 kbar, cell volume = 191.86 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAIAAAAAAAAAAAAAAIAAAAAAAAQABAAAAAAAAACAAAAAAQAQAAAAAAAgAAAAIAAAAAAACAAAAEAgAAAABAAAAgEAAAABAAACAgAAABAAAEAAAAAIAAECAAAAgAAIIAAAIAAI==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.6981
b: 5.6981
c: 5.6981
alpha: 90
beta: 90
gamma: 90
cell_volume: 185.008
crystal_density: 2.214
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56413, T = 400 C, P = 21.9 kbar, cell volume = 185.01 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7714
b: 5.7714
c: 5.7714
alpha: 90
beta: 90
gamma: 90
cell_volume: 192.240
crystal_density: 2.131
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56321, T = 450 C, P = 13.4 kbar, cell volume = 192.24 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAIAAAAAAAAAAAAAAIAAAAAAAAQABAAAAAAAAACAAAAAAQAQAAAAAABAAAAAIAAAAAAACAAAAIBAAAAABAAAAgIAAAACAAAEBAAAABAAAIAAAAAQAAECAAABAAAQQAAAQAAI==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7010
b: 5.7010
c: 5.7010
alpha: 90
beta: 90
gamma: 90
cell_volume: 185.291
crystal_density: 2.210
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56409, T = 450 C, P = 22.8 kbar, cell volume = 185.29 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAABAAAAAAAAAAAAAAAgAAAAAAAAgACAAAAAAAAAEAAAAAAgAQAAAAAAAgAAAAEAAAAAAABAAAACAQAAAAAQAAAEBAAAAAIAAAQEAAAAEAAAQAAAAAgAAIEAAABAAAQQAAAIA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.9229
b: 5.9229
c: 5.9229
alpha: 90
beta: 90
gamma: 90
cell_volume: 207.780
crystal_density: 1.971
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als9k20, T = 500 C, P = 0.0 kbar, cell volume = 207.78 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7759
b: 5.7759
c: 5.7759
alpha: 90
beta: 90
gamma: 90
cell_volume: 192.690
crystal_density: 2.126
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56317, T = 500 C, P = 14.2 kbar, cell volume = 192.69 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAIAAAAAAAAAAAAAAIAAAAAAAAQABAAAAAAAAAEAAAAAAgAgAAAAAABAAAAAQAAAAAAAEAAAAIBAAAAACAAABAQAAAACAAAECAAAACAAAIAAAAAgAAEEAAABAAAggAAAQAAQ==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7625
b: 5.7625
c: 5.7625
alpha: 90
beta: 90
gamma: 90
cell_volume: 191.352
crystal_density: 2.140
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53621, T = 500 C, P = 15.8 kbar, cell volume = 191.35 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7044
b: 5.7044
c: 5.7044
alpha: 90
beta: 90
gamma: 90
cell_volume: 185.622
crystal_density: 2.207
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56405, T = 500 C, P = 23.6 kbar, cell volume = 185.62 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAACAAAAAAAAAAAAAAAgAAAAAAABAACAAAAAAAAAEAAAAAAgAQAAAAAABAAAAAIAAAAAAABAAAACAQAAAAAgAAAICAAAAAQAAAQIAAAAIAAAgAAAABAAAIEAAACAAAggAAAQA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.9447
b: 5.9447
c: 5.9447
alpha: 90
beta: 90
gamma: 90
cell_volume: 210.082
crystal_density: 1.950
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als8k20, T = 550 C, P = 0.0 kbar, cell volume = 210.08 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAQAAAAAAAAAAAAABAAAAAAAAEAAgAAAAAAAAEAAAAABABAAAAAAAIAAAAEAAAAAAACAAAAQCAAAAAIAAAEBAAAAAgAABAgAAABAAAIAAAABAAAQIAAAEAACEAAAEAAEEAAAQ==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7795
b: 5.7795
c: 5.7795
alpha: 90
beta: 90
gamma: 90
cell_volume: 193.050
crystal_density: 2.122
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56313, T = 550 C, P = 15.0 kbar, cell volume = 193.05 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAQAAAAAAAAAAAAAAQAAAAAAAAQABAAAAAAAAAEAAAAAAgAgAAAAAACAAAAAQAAAAAAAEAAAAQCAAAAAEAAABAQAAAAEAAAECAAAAEAAAQAAAAAgAAIEAAABAABAgAAAQAAQ==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7516
b: 5.7516
c: 5.7516
alpha: 90
beta: 90
gamma: 90
cell_volume: 190.268
crystal_density: 2.153
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53693, T = 550 C, P = 17.6 kbar, cell volume = 190.27 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAEAAAAAAAAAAAAAAEAAAAAAAAIAAQAAAAAAAABAAAAAAIAEAAAAAAAQAAAACAAAAAAAAgAAACAQAAAAAQAAAIBAAAAAQAAAgIAAAAQAABAAAAACAAAQQAAAEAACCAAABAAB==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7071
b: 5.7071
c: 5.7071
alpha: 90
beta: 90
gamma: 90
cell_volume: 185.886
crystal_density: 2.203
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56401, T = 550 C, P = 24.5 kbar, cell volume = 185.89 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAACAAAAAAAAAAAAAABAAAAAAAABAAEAAAAAAAAAIAAAAAAgAgAAAAAABAAAAAIAAAAAAABAAAAEAQAAAAAgAAAICAAAAAQAAAgIAAAAIAABAAAAACAAAQIAAACAABAgAAAgA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.6990
b: 5.6990
c: 5.6990
alpha: 90
beta: 90
gamma: 90
cell_volume: 185.096
crystal_density: 2.213
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56429, T = 550 C, P = 25.1 kbar, cell volume = 185.10 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAABAAAAAAAAAAAAAAAgAAAAAAAAgACAAAAAAAAAEAAAAAAgAQAAAAAAAgAAAAEAAAAAAAAgAAACAQAAAAAQAAAEBAAAAAIAAAQEAAAAEAAAQAAAAAgAAIEAAABAAAQQAAAIA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.6991
b: 5.6991
c: 5.6991
alpha: 90
beta: 90
gamma: 90
cell_volume: 185.105
crystal_density: 2.213
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56437, T = 550 C, P = 25.1 kbar, cell volume = 185.11 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAABAAAAAAAAAAAAAAAgAAAAAAAAgACAAAAAAAAAEAAAAAAgAQAAAAAAAgAAAAEAAAAAAAAgAAACAQAAAAAQAAAEBAAAAAIAAAQEAAAAEAAAQAAAAAgAAIEAAABAAAQQAAAIA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7033
b: 5.7033
c: 5.7033
alpha: 90
beta: 90
gamma: 90
cell_volume: 185.515
crystal_density: 2.208
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56453, T = 550 C, P = 25.2 kbar, cell volume = 185.51 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAACAAAAAAAAAAAAAAAgAAAAAAABAACAAAAAAAAAEAAAAAAgAQAAAAAAAgAAAAIAAAAAAABAAAACAQAAAAAQAAAIBAAAAAQAAAQEAAAAIAAAgAAAABAAAIEAAABAAAggAAAQA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.9630
b: 5.9630
c: 5.9630
alpha: 90
beta: 90
gamma: 90
cell_volume: 212.029
crystal_density: 1.932
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als7k20, T = 600 C, P = 0.0 kbar, cell volume = 212.03 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAQAAAAAAAAAAAAACAAAAAAAAQABAAAAAAAAAQAAAAAEAEAAAAAAAgAAAAIAAAAAAAIAAABAIAAAAAgAAAQEAAAACAAAICAAAAEAABAAAAAEAACBAAAAgAAgQAAAgAAggAACA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7836
b: 5.7836
c: 5.7836
alpha: 90
beta: 90
gamma: 90
cell_volume: 193.462
crystal_density: 2.117
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56309, T = 600 C, P = 15.8 kbar, cell volume = 193.46 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7656
b: 5.7656
c: 5.7656
alpha: 90
beta: 90
gamma: 90
cell_volume: 191.661
crystal_density: 2.137
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56281, T = 600 C, P = 17.4 kbar, cell volume = 191.66 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7658
b: 5.7658
c: 5.7658
alpha: 90
beta: 90
gamma: 90
cell_volume: 191.681
crystal_density: 2.137
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53633, T = 600 C, P = 17.7 kbar, cell volume = 191.68 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7096
b: 5.7096
c: 5.7096
alpha: 90
beta: 90
gamma: 90
cell_volume: 186.130
crystal_density: 2.201
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56397, T = 600 C, P = 25.4 kbar, cell volume = 186.13 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7311
b: 5.7311
c: 5.7311
alpha: 90
beta: 90
gamma: 90
cell_volume: 188.241
crystal_density: 2.176
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53573, T = 610 C, P = 19.6 kbar, cell volume = 188.24 ang**3

qdat:
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formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7443
b: 5.7443
c: 5.7443
alpha: 90
beta: 90
gamma: 90
cell_volume: 189.545
crystal_density: 2.161
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53581, T = 620 C, P = 19.4 kbar, cell volume = 189.54 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAEAAAAAAAAAAAAAAEAAAAAAAAEAAQAAAAAAAABAAAAAAEAEAAAAAAAIAAAACAAAAAAAAQAAABAIAAAAAIAAAEBAAAAAIAAAQEAAAAEAAAgAAAABAAAQIAAACAAAggAAAgAA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7733
b: 5.7733
c: 5.7733
alpha: 90
beta: 90
gamma: 90
cell_volume: 192.430
crystal_density: 2.128
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56289, T = 625 C, P = 17.5 kbar, cell volume = 192.43 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAIAAAAAAAAAAAAAAIAAAAAAAAQABAAAAAAAAAEAAAAAAgAQAAAAAABAAAAAIAAAAAAACAAAAIBAAAAACAAAAgIAAAACAAAEBAAAACAAAIAAAAAgAAECAAABAAAggAAAQAAQ==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7483
b: 5.7483
c: 5.7483
alpha: 90
beta: 90
gamma: 90
cell_volume: 189.941
crystal_density: 2.156
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53585, T = 630 C, P = 19.2 kbar, cell volume = 189.94 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAEAAAAAAAAAAAAAAEAAAAAAAAIAAQAAAAAAAABAAAAAAEAEAAAAAAAIAAAACAAAAAAAAgAAACAIAAAAAQAAAEBAAAAAQAAAgIAAAAIAAAgAAAACAAAQIAAAEAABBAAABAAA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7535
b: 5.7535
c: 5.7535
alpha: 90
beta: 90
gamma: 90
cell_volume: 190.457
crystal_density: 2.151
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53589, T = 640 C, P = 19.0 kbar, cell volume = 190.46 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAIAAAAAAAAAAAAAAEAAAAAAAAIAAgAAAAAAAABAAAAAAIAIAAAAAAAQAAAACAAAAAAAAgAAACAQAAAAAQAAAICAAAAAQAAAgQAAAAQAABAAAAAEAAAgQAAAEAACCAAABAAB==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.9851
b: 5.9851
c: 5.9851
alpha: 90
beta: 90
gamma: 90
cell_volume: 214.395
crystal_density: 1.910
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als6k20, T = 650 C, P = 0.0 kbar, cell volume = 214.39 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAgAAAAAAAAAAAAAEAAAAAAAAgACAAAAAAAAAgAAAAAQAIAAAAAACAAAABAAAAAAAAgAAAEAgAAAACAAACAgAAAAQAAAgQAAAAgAAIAAAAAgAAQIAAAEAAEEAAAEAAIIAAAQA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7790
b: 5.7790
c: 5.7790
alpha: 90
beta: 90
gamma: 90
cell_volume: 193.000
crystal_density: 2.122
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56293, T = 650 C, P = 17.5 kbar, cell volume = 193.00 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAQAAAAAAAAAAAAAAQAAAAAAAAQABAAAAAAAAAEAAAAAAgAgAAAAAABAAAAAQAAAAAAAEAAAAQCAAAAAEAAABAQAAAAEAAAECAAAAEAAAQAAAAAgAAIEAAABAABAgAAAQAAQ==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7784
b: 5.7784
c: 5.7784
alpha: 90
beta: 90
gamma: 90
cell_volume: 192.940
crystal_density: 2.123
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56357, T = 650 C, P = 18.2 kbar, cell volume = 192.94 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAQAAAAAAAAAAAAAAIAAAAAAAAQABAAAAAAAAAEAAAAAAgAgAAAAAABAAAAAQAAAAAAAEAAAAQCAAAAACAAABAQAAAACAAAECAAAACAAAQAAAAAgAAIEAAABAABAgAAAQAAQ==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7764
b: 5.7764
c: 5.7764
alpha: 90
beta: 90
gamma: 90
cell_volume: 192.740
crystal_density: 2.125
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56373, T = 650 C, P = 18.2 kbar, cell volume = 192.74 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAIAAAAAAAAAAAAAAIAAAAAAAAQABAAAAAAAAAEAAAAAAgAgAAAAAABAAAAAQAAAAAAAEAAAAQBAAAAACAAABAQAAAACAAAECAAAACAAAQAAAAAgAAEEAAABAAAggAAAQAAQ==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7576
b: 5.7576
c: 5.7576
alpha: 90
beta: 90
gamma: 90
cell_volume: 190.864
crystal_density: 2.146
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53593, T = 650 C, P = 18.8 kbar, cell volume = 190.86 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAIAAAAAAAAAAAAAAEAAAAAAAAIAAgAAAAAAAACAAAAAAIAIAAAAAAAQAAAAEAAAAAAABAAAACAQAAAAAgAAAICAAAAAgAABAQAAAAgAACAAAAAEAABAgAAAIAAECAAACAAB==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7124
b: 5.7124
c: 5.7124
alpha: 90
beta: 90
gamma: 90
cell_volume: 186.404
crystal_density: 2.197
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56393, T = 650 C, P = 26.3 kbar, cell volume = 186.40 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAACAAAAAAAAAAAAAABAAAAAAAABAAEAAAAAAAAAIAAAAABAAgAAAAAABAAAAAQAAAAAAACAAAAEAgAAAAAgAAAQCAAAAAgAAAgQAAAAQAABAAAAACAAAgQAAACAACBAAAAgA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7092
b: 5.7092
c: 5.7092
alpha: 90
beta: 90
gamma: 90
cell_volume: 186.091
crystal_density: 2.201
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56381, T = 650 C, P = 26.8 kbar, cell volume = 186.09 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAACAAAAAAAAAAAAAABAAAAAAAABAAEAAAAAAAAAIAAAAAAgAgAAAAAABAAAAAIAAAAAAABAAAAEAgAAAAAgAAAQCAAAAAgAAAgIAAAAQAABAAAAACAAAQIAAACAABBAAAAgA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7693
b: 5.7693
c: 5.7693
alpha: 90
beta: 90
gamma: 90
cell_volume: 192.030
crystal_density: 2.133
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r53601, T = 675 C, P = 19.0 kbar, cell volume = 192.03 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAIAAAAAAAAAAAAAAIAAAAAAAAQABAAAAAAAAACAAAAAAQAQAAAAAAAgAAAAIAAAAAAACAAAAIAgAAAABAAAAgIAAAABAAACBAAAABAAAEAAAAAQAAECAAAAgAAQQAAAIAAI==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7898
b: 5.7898
c: 5.7898
alpha: 90
beta: 90
gamma: 90
cell_volume: 194.084
crystal_density: 2.110
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56297, T = 700 C, P = 17.5 kbar, cell volume = 194.08 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAQAAAAAAAAAAAAAAQAAAAAAAAgACAAAAAAAAAIAAAAABABAAAAAAACAAAAAgAAAAAAAIAAAAgEAAAAAIAAACAgAAAAIAAAQIAAAAIAAAgAAAACAAAgQAAAEAACCAAACAABB==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7133
b: 5.7133
c: 5.7133
alpha: 90
beta: 90
gamma: 90
cell_volume: 186.492
crystal_density: 2.196
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56385, T = 700 C, P = 27.2 kbar, cell volume = 186.49 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAACAAAAAAAAAAAAAABAAAAAAAABAAEAAAAAAAAAIAAAAABAAgAAAAAABAAAAAQAAAAAAACAAAAEAgAAAAAgAAAQEAAAAAgAAAgQAAAAQAABAAAAACAAAgQAAAEAACBAAAAgA==


formula: (K.2 Na.8) Cl
compound: <missing>
formula_title: (K.2Na.8)Cl
a: 5.7084
b: 5.7084
c: 5.7084
alpha: 90
beta: 90
gamma: 90
cell_volume: 186.013
crystal_density: 2.202
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: ADUMAADUMAAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: r56441, T = 700 C, P = 28.2 kbar, cell volume = 186.01 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAACAAAAAAAAAAAAAABAAAAAAAABAAEAAAAAAAAAIAAAAAAgAgAAAAAABAAAAAIAAAAAAABAAAAEAQAAAAAgAAAICAAAAAgAAAgIAAAAQAABAAAAACAAAQIAAACAABBAAAAgA==


formula: (K.1 Na.9) Cl
compound: <missing>
pub_title: Halite-sylvite thermoelasticity Sample: b&w, T = 25 C, P = 0.0 kbar, cell volume = 186.59 ang**3
formula_title: (K.1Na.9)Cl
a: 5.7143
b: 5.7143
c: 5.7143
alpha: 90
beta: 90
gamma: 90
cell_volume: 186.590
crystal_density: 2.138
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gBoGAIDuNgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAACAAAAAAAAAAAAAABAAAAAAAABAAEAAAAAAAAAIAAAAABAAgAAAAAABAAAAAQAAAAAAACAAAAIAgAAAABAAAAQEAAAAAgAABAQAAAAQAABAAAAACAAAgQAAAEAACBAAAAgA==


formula: (K.1 Na.9) Cl
compound: <missing>
formula_title: (K.1Na.9)Cl
a: 5.8632
b: 5.8632
c: 5.8632
alpha: 90
beta: 90
gamma: 90
cell_volume: 201.560
crystal_density: 1.979
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gBoGAIDuNgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als3k10, T = 550 C, P = 0.0 kbar, cell volume = 201.56 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAACAAAAAAAAAAAAAAEAAAAAAAAQABAAAAAAAAAEAAAAABABAAAAAAAEAAAABAAAAAAAAgAAACAQAAAAAgAAAQEAAAABAAAEBAAAACAAAQAAAABAAAQIAAAEAACCAAABAABCAA==


formula: (K.1 Na.9) Cl
compound: <missing>
formula_title: (K.1Na.9)Cl
a: 5.8840
b: 5.8840
c: 5.8840
alpha: 90
beta: 90
gamma: 90
cell_volume: 203.713
crystal_density: 1.958
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gBoGAIDuNgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als2k10, T = 600 C, P = 0.0 kbar, cell volume = 203.71 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAEAAAAAAAAAAAAAAIAAAAAAAAgACAAAAAAAAAQAAAAACACAAAAAAAQAAAAEAAAAAAACAAAAIBAAAAAEAAACAgAAAAIAAAgIAAAAQAACAAAAAIAACCAAAAgAAQQAAAQAAQQAA==


formula: (K.1 Na.9) Cl
compound: <missing>
formula_title: (K.1Na.9)Cl
a: 5.9032
b: 5.9032
c: 5.9032
alpha: 90
beta: 90
gamma: 90
cell_volume: 205.713
crystal_density: 1.939
atoms_sites: ["K", "Na", "Cl"]
atoms_x: AAAAAAAAAACAhB4A
atoms_y: AAAAAAAAAACAhB4A
atoms_z: AAAAAAAAAACAhB4A
atoms_occupancy: gBoGAIDuNgAACT0A
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: als1k10, T = 650 C, P = 0.0 kbar, cell volume = 205.71 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAEAAAAAAAAAAAAAAQAAAAAAABAAEAAAAAAAAAgAAAAAIAIAAAAAABAAAAAQAAAAAAAIAAAAgEAAAAAQAAAICAAAABAAACAgAAACAAAQAAAAAgAAQQAAAEAACCAAACAACCAAA==


formula: Na Cl
compound: <missing>
formula_title: <missing>
a: 5.6401
b: 5.6401
c: 5.6401
alpha: 90
beta: 90
gamma: 90
cell_volume: 179.416
crystal_density: 2.164
atoms_sites: ["Na", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl416031, T = 25 C, P = 0.0 kbar, cell volume = 179.42 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAAEAAAAAAAAAAAIAAAAAAAAAIAAAAAAAAgAAAAAAAgAAAAAAAAAAAAAgAAAAAIAAAAAEAAAAAQAAAACAAAABAAAAAgAAAAAAAAEAAAAQAAAEAAABAAAA==


formula: Na Cl
compound: <missing>
formula_title: <missing>
a: 5.6530
b: 5.6530
c: 5.6530
alpha: 90
beta: 90
gamma: 90
cell_volume: 180.650
crystal_density: 2.149
atoms_sites: ["Na", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl416032, T = 100 C, P = 0.0 kbar, cell volume = 180.65 ang**3

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAAAAIAAAAAAAAAAAQAAAAAAAAAQAAAAAAABAAAAAAABAAAAAAAAAAAAABAAAAAAQAAAAAQAAAABAAAAAIAAAACAAAACAAAAAAAAAQAAACAAAAQAAAEAAAC==


formula: Na Cl
compound: <missing>
formula_title: <missing>
a: 5.6850
b: 5.6850
c: 5.6850
alpha: 90
beta: 90
gamma: 90
cell_volume: 183.735
crystal_density: 2.113
atoms_sites: ["Na", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
atoms_occupancy: 0
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atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl416033, T = 200 C, P = 0.0 kbar, cell volume = 183.73 ang**3

qdat:
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formula: Na Cl
compound: <missing>
formula_title: <missing>
a: 5.7071
b: 5.7071
c: 5.7071
alpha: 90
beta: 90
gamma: 90
cell_volume: 185.886
crystal_density: 2.088
atoms_sites: ["Na", "Cl"]
atoms_x: AAAAAICEHgA=
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pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl416034, T = 300 C, P = 0.0 kbar, cell volume = 185.89 ang**3

qdat:
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formula: Na Cl
compound: <missing>
formula_title: <missing>
a: 5.7320
b: 5.7320
c: 5.7320
alpha: 90
beta: 90
gamma: 90
cell_volume: 188.330
crystal_density: 2.061
atoms_sites: ["Na", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl416035, T = 400 C, P = 0.0 kbar, cell volume = 188.33 ang**3

qdat:
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formula: Na Cl
compound: <missing>
formula_title: <missing>
a: 5.7632
b: 5.7632
c: 5.7632
alpha: 90
beta: 90
gamma: 90
cell_volume: 191.422
crystal_density: 2.028
atoms_sites: ["Na", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
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atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl416036, T = 500 C, P = 0.0 kbar, cell volume = 191.42 ang**3

qdat:
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formula: Na Cl
compound: <missing>
formula_title: <missing>
a: 5.7915
b: 5.7915
c: 5.7915
alpha: 90
beta: 90
gamma: 90
cell_volume: 194.255
crystal_density: 1.998
atoms_sites: ["Na", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Halite-sylvite thermoelasticity
 Sample: msl416037, T = 600 C, P = 0.0 kbar, cell volume = 194.26 ang**3

qdat:
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formula: (K.91 Ba.09) Mn1.53 Ti.03 Al1.74 Fe.21 Mg.93 Si2.56 O11.98 F.02 H1.98
compound: <missing>
formula_title: <missing>
a: 5.3791
b: 9.319
c: 10.2918
alpha: 90
beta: 100.186
gamma: 90
cell_volume: 507.774
crystal_density: 3.144
pub_title:
 Shirozulite, KMn3(Si3Al)O10(OH)2, a new manganese-dominant trioctahedral mica:
 Description and crystal structure
 Note: Displacement factors for O1, O2 and O4 have been altered.

atoms_sites:
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qdat:
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formula: Ba4 K1.6 Na.4 Ti4 Si10 Al2 O41.02 H10.2
compound: Benitoite mine, New Idria District, San Benito Co., California, USA
formula_title: <missing>
a: 10.618
b: 25.918
c: 8.6945
alpha: 90
beta: 127.633
gamma: 90
cell_volume: 1894.873
crystal_density: 3.179
atoms_aniso_label: "<missing>"
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atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 The crystal structure of jonesite, Ba2(K,Na)[Ti2(Si5Al)O18(H2O)](H2O)n:
 A first example of titanosilicate with porous double layers

atoms_sites:
["Ba1", "Ba2", "K1", "Na1", "K2", "Na2", "K3", "Ti1", "Ti2", "Si1", "Si2", "Si3", "Si4", "Si5", "Al5", "Si6", "Al6", "Si5A", "Al5A", "Si6A", "Al6A", "O1", "O2", "O3", "O4", "O5", "O6", "Wat6", "Wat7", "O7A", "O8", "O8A", "O9", "O10", "O11", "O12", "O13", "O14", "O14A", "O15", "O15A", "O16", "O17", "O18", "O19", "O19A", "O20", "O20A", "Wat21", "Wat22", "Wat23", "Wat24", "Wat25"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

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qdat:
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formula: U6 Pb3 O25 H8
compound: <missing>
formula_title: <missing>
a: 28.355
b: 11.990
c: 13.998
alpha: 90
beta: 104.248
gamma: 90
cell_volume: 4612.602
crystal_density: 7.079
atoms_aniso_label: ["U1", "U2", "U3", "U4", "U5", "U6", "Pb1", "Pb2", "Pb3", "Pb4", "Pb5", "Pb6"]
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atoms_aniso_u22: 0J0AANCdAAAgywAAgLsAADDAAACgvgAAMMAAAGDeAgAgvwIA4CgBACC5AwDgEAUA
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pub_title:
 Spriggite, Pb3[(UO2)6O8(OH)2](H2O)3, a new mineral with beta-U3O8 - type sheets:
 Description and crystal structure

atoms_sites:
["U1", "U2", "U3", "U4", "U5", "U6", "Pb1", "Pb2", "Pb3", "Pb4", "Pb5", "Pb6", "Pb7", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O-H16", "O-H17", "O18", "O19", "O20", "O21", "O22", "Wat1", "Wat2", "Wat3", "Wat4", "Wat5"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

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qdat:
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formula: Na4 Al3 Si3 O12 Cl
compound: <missing>
formula_title: <missing>
a: 8.88696
b: 8.88696
c: 8.88696
alpha: 90
beta: 90
gamma: 90
cell_volume: 701.875
crystal_density: 2.293
atoms_sites: ["Na", "Al", "Si", "O", "Cl"]
atoms_x: sNsKAEBCDwBAQg8AcIcIAAAAAAA=
atoms_y: sNsKAAAAAACAhB4AyCkJAAAAAAA=
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atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 28 C

qdat:
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formula: Na4 Al3 Si3 O12 Cl
compound: <missing>
formula_title: <missing>
a: 8.88689
b: 8.88689
c: 8.88689
alpha: 90
beta: 90
gamma: 90
cell_volume: 701.858
crystal_density: 2.293
atoms_sites: ["Na", "Al", "Si", "O", "Cl"]
atoms_x: 0N4KAEBCDwBAQg8AEIMIAAAAAAA=
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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 43 C

qdat:
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formula: Na4 Al3 Si3 O12 Cl
compound: <missing>
formula_title: <missing>
a: 8.88850
b: 8.88850
c: 8.88850
alpha: 90
beta: 90
gamma: 90
cell_volume: 702.240
crystal_density: 2.292
atoms_sites: ["Na", "Al", "Si", "O", "Cl"]
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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 58 C

qdat:
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formula: Na4 Al3 Si3 O12 Cl
compound: <missing>
formula_title: <missing>
a: 8.89540
b: 8.89540
c: 8.89540
alpha: 90
beta: 90
gamma: 90
cell_volume: 703.877
crystal_density: 2.286
atoms_sites: ["Na", "Al", "Si", "O", "Cl"]
atoms_x: YOAKAEBCDwBAQg8AcJEIAAAAAAA=
atoms_y: YOAKAAAAAACAhB4AUDMJAAAAAAA=
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 104 C

qdat:
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formula: Na4 Al3 Si3 O12 Cl
compound: <missing>
formula_title: <missing>
a: 8.90171
b: 8.90171
c: 8.90171
alpha: 90
beta: 90
gamma: 90
cell_volume: 705.375
crystal_density: 2.282
atoms_sites: ["Na", "Al", "Si", "O", "Cl"]
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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 164 C

qdat:
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formula: Na4 Al3 Si3 O12 Cl
compound: <missing>
formula_title: <missing>
a: 8.91423
b: 8.91423
c: 8.91423
alpha: 90
beta: 90
gamma: 90
cell_volume: 708.356
crystal_density: 2.272
atoms_sites: ["Na", "Al", "Si", "O", "Cl"]
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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 270 C

qdat:
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formula: Na4 Al3 Si3 O12 Cl
compound: <missing>
formula_title: <missing>
a: 8.92782
b: 8.92782
c: 8.92782
alpha: 90
beta: 90
gamma: 90
cell_volume: 711.601
crystal_density: 2.262
atoms_sites: ["Na", "Al", "Si", "O", "Cl"]
atoms_x: YPkKAEBCDwBAQg8ASKUIAAAAAAA=
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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 376 C

qdat:
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formula: Na4 Al3 Si3 O12 Cl
compound: <missing>
formula_title: <missing>
a: 8.94177
b: 8.94177
c: 8.94177
alpha: 90
beta: 90
gamma: 90
cell_volume: 714.941
crystal_density: 2.251
atoms_sites: ["Na", "Al", "Si", "O", "Cl"]
atoms_x: gPwKAEBCDwBAQg8ASK8IAAAAAAA=
atoms_y: gPwKAAAAAACAhB4AmE8JAAAAAAA=
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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 482 C

qdat:
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formula: Na4 Al3 Si3 O12 Cl
compound: <missing>
formula_title: <missing>
a: 8.95963
b: 8.95963
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alpha: 90
beta: 90
gamma: 90
cell_volume: 719.234
crystal_density: 2.238
atoms_sites: ["Na", "Al", "Si", "O", "Cl"]
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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 588 C

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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 694 C

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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
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 Sample: T = 800 C

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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 906 C

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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 967 C

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formula: Na4 Al3 Si3 O12 Cl
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pub_title:
 Sodalite: High-temperature structures obtained from synchrotron radiation
 and Rietveld refinements
 Sample: T = 982 C

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formula: Fe2 S2 O13 H8
compound: <missing>
pub_title: The structure of metahohmannite, Fe2[O(SO4)2].4H2O, by in situ synchrotron powder diffraction
formula_title: <missing>
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formula: Dy6 Si6 O21
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pub_title:
 A new rare earth disilicate (REE2Si2O7: REE = Dy, Tm, Lu; type-L):
 Evidence for nonquenchable 10 GPa polymorph with silicon
 in fivefold trigonal bipyramidal coordination?

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formula: Tm5.902 Si6 O21
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pub_title:
 A new rare earth disilicate (REE2Si2O7: REE = Dy, Tm, Lu; type-L):
 Evidence for nonquenchable 10 GPa polymorph with silicon
 in fivefold trigonal bipyramidal coordination?

atoms_sites:
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pub_title:
 A new rare earth disilicate (REE2Si2O7: REE = Dy, Tm, Lu; type-L):
 Evidence for nonquenchable 10 GPa polymorph with silicon
 in fivefold trigonal bipyramidal coordination?

atoms_sites:
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formula: Ca2 Fe2 O5
compound: Synthetic
formula_title: <missing>
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b: 14.7631
c: 5.5969
alpha: 90
beta: 90
gamma: 90
cell_volume: 448.403
crystal_density: 4.027
atoms_sites: ["Ca", "FeM", "FeT", "O1", "O2", "O3"]
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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bx000_1

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formula: Ca2 (Fe1.886 Al.114) O5
compound: Synthetic
formula_title: <missing>
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alpha: 90
beta: 90
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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht005_2

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formula: Ca2 (Fe1.796 Al.204) O5
compound: Synthetic
formula_title: <missing>
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alpha: 90
beta: 90
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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht015_1

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht025_2

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht030_3

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht035_1

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht040_2

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bf80i_2

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht55_1

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht50_2

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht070_1

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht120_6

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht095_2

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht100_2

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht110n1

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht120n2

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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht130_2

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beta: 90
gamma: 90
cell_volume: 421.711
crystal_density: 3.670
atoms_sites: ["Ca", "FeM", "AlM", "FeT", "AlT", "O1", "O2", "O3"]
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pub_title:
 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5:
 Single-crystal X-ray diffraction at 25 deg C and high temperature
 X-ray powder diffraction (25 C <= T <= 1000 C)
 Sample: bht140_2

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pub_title:
 Peculiarity and defect structure of the natural and synthetic zeolite mordenite:
 A single-crystal X-ray study
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pub_title:
 Peculiarity and defect structure of the natural and synthetic zeolite mordenite:
 A single-crystal X-ray study
 Sample: synthetic

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pub_title:
 Structural and chemical response to varying B content in zoned Fe-bearing olenite
 from Koralpe, Austria
 Sample: T1

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pub_title:
 Structural and chemical response to varying B content in zoned Fe-bearing olenite
 from Koralpe, Austria
 Sample: T2

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pub_title:
 Structural and chemical response to varying B content in zoned Fe-bearing olenite
 from Koralpe, Austria
 Sample: T3

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pub_title:
 Structural and chemical response to varying B content in zoned Fe-bearing olenite
 from Koralpe, Austria
 Sample: T4

atoms_sites:
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pub_title:
 Structural and chemical response to varying B content in zoned Fe-bearing olenite
 from Koralpe, Austria
 Sample: T5

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pub_title:
 Tugtupite: High-temperature structures obtained from in situ synchrotron
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pub_title:
 Tugtupite: High-temperature structures obtained from in situ synchrotron
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pub_title:
 Tugtupite: High-temperature structures obtained from in situ synchrotron
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pub_title:
 Tugtupite: High-temperature structures obtained from in situ synchrotron
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pub_title:
 Tugtupite: High-temperature structures obtained from in situ synchrotron
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pub_title:
 Tugtupite: High-temperature structures obtained from in situ synchrotron
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