[Ifeffit] error message by import
Robert Gordon
moyie.institute at gmail.com
Wed Apr 8 08:18:35 CDT 2015
Hi Anna,
It would be helpful to know a bit more about your problem.
What version are you running? Could you provide the file?
I have version 0.9.21x64 and encounter no difficulty importing a 2-column
text file such as the attached.
With regards to your other query, there is a stand-alone version of
atoms that came with 0.9.21.
It is visible in the windows start menu for me and opens the same window
that I get if I try
to import an atom.inp or feff.inp from D'Artemis.
best regards,
Robert
On 4/8/2015 4:47 AM, Zimina, Anna (IKFT) wrote:
>
> I get the following error message when I read the txt file with two
> columns of data (energy and intensity):
>
> “11:42:20: Use of uninitialized value $line in pattern match (m//) at
> C:/strawberry/perl/site/lib/Demeter/Files.pm line 188.”
>
> Still the data can be read. What is the problem?
>
> Thanks in advance,
>
> Anna Zimina.
>
> ______________________________________________________________________________________
>
> Karlsruhe Institute of Technology (KIT)
>
> Institute of Catalysis Research and Technology (IKFT)
>
> Dr. Anna Zimina
>
> Beamline scientist
>
> Hermann-von-Helmholtz-Platz 1
>
> Building 345, Office 108
>
> 76344 Eggenstein-Leopoldshafen
>
> Phone: +49 721 608 28673
>
> Fax: +49 721 608 26789
>
> E-Mail anna.zimina at kit.edu <mailto:anna.zimina at kit.edu>
>
> xasf16
>
>
>
> _______________________________________________
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--
Dr. Robert Gordon
9700 S Cass Ave. 435E
Argonne, IL, USA 60439
630-252-0581
630-252-0580 fax
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# data : Fe, using Feff standard
# chi: from skey ASCII of newfe.b
# using simple minimization
# e0 = 7110.98; pre-edge range =[ -200.0 -50.0]; edge step = 2.108
# k range=[ 1.00 17.60]; k weight= 1.00; sills dk1, dk2 = 0.00 0.00
# bkg r =[ 0.00 0.98]; 11 knots in spline
# inpdat: no document line found
# ----------------------------------------------------------------------
# k chi(k)
0.5000000E-01 0.0000000E+00
0.1000000E+00 0.0000000E+00
0.1500000E+00 0.0000000E+00
0.2000000E+00 0.0000000E+00
0.2500000E+00 0.0000000E+00
0.3000000E+00 0.0000000E+00
0.3500000E+00 0.0000000E+00
0.4000000E+00 0.0000000E+00
0.4500000E+00 0.0000000E+00
0.5000000E+00 0.0000000E+00
0.5500000E+00 0.0000000E+00
0.6000000E+00 0.0000000E+00
0.6500000E+00 0.0000000E+00
0.7000000E+00 0.0000000E+00
0.7500000E+00 0.0000000E+00
0.8000000E+00 0.0000000E+00
0.8500000E+00 0.0000000E+00
0.9000000E+00 0.0000000E+00
0.9500000E+00 0.5655127E-01
0.1000000E+01 0.2060084E+00
0.1050000E+01 0.2808007E+00
0.1100000E+01 0.2122846E+00
0.1150000E+01 0.1469233E+00
0.1200000E+01 0.8558236E-01
0.1250000E+01 0.3885868E-01
0.1300000E+01 -.3205625E-02
0.1350000E+01 -.2988494E-01
0.1400000E+01 -.5032800E-01
0.1450000E+01 -.6352721E-01
0.1500000E+01 -.6917974E-01
0.1550000E+01 -.6984850E-01
0.1600000E+01 -.6646661E-01
0.1650000E+01 -.6563130E-01
0.1700000E+01 -.6711814E-01
0.1750000E+01 -.6834159E-01
0.1800000E+01 -.6921581E-01
0.1850000E+01 -.6814639E-01
0.1900000E+01 -.6501906E-01
0.1950000E+01 -.5765744E-01
0.2000000E+01 -.4453135E-01
0.2050000E+01 -.2401327E-01
0.2100000E+01 0.7335357E-02
0.2150000E+01 0.4488946E-01
0.2200000E+01 0.7977872E-01
0.2250000E+01 0.9853840E-01
0.2300000E+01 0.9232492E-01
0.2350000E+01 0.6178783E-01
0.2400000E+01 0.2341145E-01
0.2450000E+01 -.1390825E-01
0.2500000E+01 -.3846206E-01
0.2550000E+01 -.5195529E-01
0.2600000E+01 -.5546389E-01
0.2650000E+01 -.4779275E-01
0.2700000E+01 -.3509258E-01
0.2750000E+01 -.2234229E-01
0.2800000E+01 -.1596326E-01
0.2850000E+01 -.1899550E-01
0.2900000E+01 -.2327369E-01
0.2950000E+01 -.2792808E-01
0.3000000E+01 -.2152839E-01
0.3050000E+01 -.8976581E-02
0.3100000E+01 0.9856174E-02
0.3150000E+01 0.2660002E-01
0.3200000E+01 0.3893804E-01
0.3250000E+01 0.4660523E-01
0.3300000E+01 0.5051752E-01
0.3350000E+01 0.5078438E-01
0.3400000E+01 0.4720417E-01
0.3450000E+01 0.4192519E-01
0.3500000E+01 0.3830658E-01
0.3550000E+01 0.3661301E-01
0.3600000E+01 0.3510318E-01
0.3650000E+01 0.3195203E-01
0.3700000E+01 0.2673356E-01
0.3750000E+01 0.2157586E-01
0.3800000E+01 0.1734317E-01
0.3850000E+01 0.1420028E-01
0.3900000E+01 0.1007945E-01
0.3950000E+01 0.3650033E-02
0.4000000E+01 -.5376017E-02
0.4050000E+01 -.1947654E-01
0.4100000E+01 -.3440827E-01
0.4150000E+01 -.5013820E-01
0.4200000E+01 -.6089725E-01
0.4250000E+01 -.6645940E-01
0.4300000E+01 -.6661560E-01
0.4350000E+01 -.6047763E-01
0.4400000E+01 -.5072961E-01
0.4450000E+01 -.3719363E-01
0.4500000E+01 -.1978667E-01
0.4550000E+01 -.1746187E-02
0.4600000E+01 0.1679161E-01
0.4650000E+01 0.2691962E-01
0.4700000E+01 0.2806893E-01
0.4750000E+01 0.2038168E-01
0.4800000E+01 0.3018849E-02
0.4850000E+01 -.1650919E-01
0.4900000E+01 -.3837207E-01
0.4950000E+01 -.5877454E-01
0.5000000E+01 -.7065932E-01
0.5050000E+01 -.7365970E-01
0.5100000E+01 -.4566274E-01
0.5150000E+01 -.5775657E-02
0.5200000E+01 0.4637155E-01
0.5250000E+01 0.1188507E+00
0.5300000E+01 0.1364345E+00
0.5350000E+01 0.1535101E+00
0.5400000E+01 0.1421802E+00
0.5450000E+01 0.1174440E+00
0.5500000E+01 0.8106687E-01
0.5550000E+01 0.3828398E-01
0.5600000E+01 -.2915186E-02
0.5650000E+01 -.4199471E-01
0.5700000E+01 -.6625038E-01
0.5750000E+01 -.8051391E-01
0.5800000E+01 -.8474813E-01
0.5850000E+01 -.7489974E-01
0.5900000E+01 -.6144758E-01
0.5950000E+01 -.4510938E-01
0.6000000E+01 -.3562258E-01
0.6050000E+01 -.3317802E-01
0.6100000E+01 -.3701793E-01
0.6150000E+01 -.4274058E-01
0.6200000E+01 -.4226617E-01
0.6250000E+01 -.3624063E-01
0.6300000E+01 -.2621241E-01
0.6350000E+01 -.1714197E-01
0.6400000E+01 -.8579194E-02
0.6450000E+01 0.5889795E-02
0.6500000E+01 0.2112563E-01
0.6550000E+01 0.3640528E-01
0.6600000E+01 0.4407941E-01
0.6650000E+01 0.5381595E-01
0.6700000E+01 0.6523077E-01
0.6750000E+01 0.7810715E-01
0.6800000E+01 0.8461104E-01
0.6850000E+01 0.8472789E-01
0.6900000E+01 0.6481350E-01
0.6950000E+01 0.4050279E-01
0.7000000E+01 0.1361891E-01
0.7050000E+01 -.7456295E-02
0.7100000E+01 -.2335217E-01
0.7150000E+01 -.3496600E-01
0.7200000E+01 -.3856641E-01
0.7250000E+01 -.3877619E-01
0.7300000E+01 -.3681451E-01
0.7350000E+01 -.3596700E-01
0.7400000E+01 -.3518155E-01
0.7450000E+01 -.3437710E-01
0.7500000E+01 -.3310297E-01
0.7550000E+01 -.3291784E-01
0.7600000E+01 -.3388389E-01
0.7650000E+01 -.3860017E-01
0.7700000E+01 -.4055087E-01
0.7750000E+01 -.3946792E-01
0.7800000E+01 -.2831430E-01
0.7850000E+01 -.1267608E-01
0.7900000E+01 0.5823306E-02
0.7950000E+01 0.2277069E-01
0.8000000E+01 0.3800438E-01
0.8050000E+01 0.5176166E-01
0.8100000E+01 0.6261042E-01
0.8150000E+01 0.6892227E-01
0.8200000E+01 0.7097669E-01
0.8250000E+01 0.6260683E-01
0.8300000E+01 0.4178878E-01
0.8350000E+01 0.1626553E-01
0.8400000E+01 -.6038480E-02
0.8450000E+01 -.2388303E-01
0.8500000E+01 -.3694926E-01
0.8550000E+01 -.3524959E-01
0.8600000E+01 -.3015273E-01
0.8650000E+01 -.2355439E-01
0.8700000E+01 -.2037353E-01
0.8750000E+01 -.1821713E-01
0.8800000E+01 -.1653979E-01
0.8850000E+01 -.1375826E-01
0.8900000E+01 -.1138593E-01
0.8950000E+01 -.9640670E-02
0.9000000E+01 -.1064719E-01
0.9050000E+01 -.1333986E-01
0.9100000E+01 -.1657897E-01
0.9150000E+01 -.1563255E-01
0.9200000E+01 -.1256403E-01
0.9250000E+01 -.7546475E-02
0.9300000E+01 0.2051769E-02
0.9350000E+01 0.1206484E-01
0.9400000E+01 0.2186381E-01
0.9450000E+01 0.2696188E-01
0.9500000E+01 0.2956321E-01
0.9550000E+01 0.3024703E-01
0.9600000E+01 0.2829097E-01
0.9650000E+01 0.2347386E-01
0.9700000E+01 0.1677168E-01
0.9750000E+01 0.9652683E-02
0.9800000E+01 0.4160130E-02
0.9850000E+01 -.3509654E-03
0.9900000E+01 -.5822503E-02
0.9950000E+01 -.1127272E-01
0.1000000E+02 -.1622435E-01
0.1005000E+02 -.1683732E-01
0.1010000E+02 -.1495159E-01
0.1015000E+02 -.1141029E-01
0.1020000E+02 -.8467363E-02
0.1025000E+02 -.7214359E-02
0.1030000E+02 -.7081313E-02
0.1035000E+02 -.6969263E-02
0.1040000E+02 -.6049700E-02
0.1045000E+02 -.4485105E-02
0.1050000E+02 -.1890426E-02
0.1055000E+02 -.4006150E-03
0.1060000E+02 0.2384959E-03
0.1065000E+02 0.4834935E-04
0.1070000E+02 0.5550277E-03
0.1075000E+02 0.1837278E-02
0.1080000E+02 0.5715432E-02
0.1085000E+02 0.9587295E-02
0.1090000E+02 0.1308050E-01
0.1095000E+02 0.1318570E-01
0.1100000E+02 0.1114541E-01
0.1105000E+02 0.7585354E-02
0.1110000E+02 0.2712361E-02
0.1115000E+02 -.6231128E-03
0.1120000E+02 -.2699086E-02
0.1125000E+02 -.2748458E-02
0.1130000E+02 -.2100015E-02
0.1135000E+02 -.1248769E-02
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0.1150000E+02 -.4079884E-02
0.1155000E+02 -.3113230E-02
0.1160000E+02 -.1657446E-02
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0.1170000E+02 -.4868633E-03
0.1175000E+02 -.1869108E-02
0.1180000E+02 -.3666880E-02
0.1185000E+02 -.5012533E-02
0.1190000E+02 -.5430240E-02
0.1195000E+02 -.5244704E-02
0.1200000E+02 -.4244526E-02
0.1205000E+02 -.2583137E-02
0.1210000E+02 -.5613900E-03
0.1215000E+02 0.1682533E-02
0.1220000E+02 0.3550175E-02
0.1225000E+02 0.4962454E-02
0.1230000E+02 0.5145181E-02
0.1235000E+02 0.4521211E-02
0.1240000E+02 0.3616649E-02
0.1245000E+02 0.3025508E-02
0.1250000E+02 0.2215167E-02
0.1255000E+02 0.1239767E-02
0.1260000E+02 -.2847800E-04
0.1265000E+02 -.8736346E-03
0.1270000E+02 -.1316044E-02
0.1275000E+02 -.8352873E-03
0.1280000E+02 -.6000087E-03
0.1285000E+02 -.4739623E-03
0.1290000E+02 -.3565089E-03
0.1295000E+02 -.4024917E-03
0.1300000E+02 -.4363919E-03
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0.1345000E+02 -.1130186E-02
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0.1355000E+02 0.3457512E-03
0.1360000E+02 0.7712489E-03
0.1365000E+02 0.9736323E-03
0.1370000E+02 0.1358593E-02
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0.1385000E+02 0.1780056E-02
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0.1515000E+02 0.1410443E-02
0.1520000E+02 0.1331813E-02
0.1525000E+02 0.1170310E-02
0.1530000E+02 0.1064512E-02
0.1535000E+02 0.1075089E-02
0.1540000E+02 0.1058487E-02
0.1545000E+02 0.8618844E-03
0.1550000E+02 0.6286561E-03
0.1555000E+02 0.3808540E-03
0.1560000E+02 0.1252981E-03
0.1565000E+02 -.6006536E-05
0.1570000E+02 -.1575533E-03
0.1575000E+02 -.4507753E-03
0.1580000E+02 -.7327566E-03
0.1585000E+02 -.9702140E-03
0.1590000E+02 -.1102900E-02
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0.1600000E+02 -.1133195E-02
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0.1735000E+02 0.3222296E-04
0.1740000E+02 0.1552839E-03
0.1745000E+02 0.3968782E-03
0.1750000E+02 0.5713292E-03
0.1755000E+02 0.6374749E-03
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