# Artemis project file -- Artemis version 0.6.005 # This file created at 04:08:40 on 25 September, 2004 # using Windows XP, perl 5.006001, and Ifeffit 1.2.1 $old_path = 'gsd'; @args = ('ss',{'value' => '0','choice' => 'guess','name' => 'ss'},'order',['amp','e0','delr','ss2','descale','ss1','ssmg'],'type','gsd','delscale',{'value' => '0','name' => 'Delscale','choice' => 'guess'},'ssmg',{'value' => '0.003','choice' => 'skip','name' => 'ssmg'},'delr',{'value' => 'Descale*reff','choice' => 'def','name' => 'delr'},'amp',{'value' => '0','choice' => 'guess','name' => 'amp'},'ss1',{'value' => '0.003','choice' => 'guess','name' => 'ss1'},'line',0,'ss2',{'value' => '0.003','choice' => 'guess','name' => 'ss2'},'descale',{'value' => '0','choice' => 'guess','name' => 'Descale'},'id','gsd','e0',{'value' => '0','choice' => 'guess','name' => 'e0'},'ssv',{'value' => '0.003','name' => 'ssv','choice' => 'guess'}); [record] $old_path = 'data0'; @args = ('kmin','4','dr','0.1','cormin','0.25','karb','','group','data0','data_index',1,'rwindow','Kaiser-Bessel','is_rec',0,'fit_space','R','lab','reortho123_real.chi','pcelem','V','do_bkg','no','rmax','4','pcplot','No','line',0,'rmin',1,'id','data0','sameas',0,'chib',0,'k1',0,'k2',0,'k3',1,'type','data','epsilon_k','','use_bkg',0,'pcedge','v k','include',1,'karb_use',0,'kwindow','Kaiser-Bessel','pcpath','None','dk',1,'kmax','10','file','C:/Documents and Settings/HSNUboy/����/Argonne-2004/analysis/orthoVMgO/reortho123_real.chi'); @strings = (); [record] $old_path = 'data0.feff0'; @args = ('path','C:/Documents and Settings/HSNUboy/����/IFEFFITanalysis/Mg3V2O8/','group','data0.feff0','central','V','files.dat','C:\\Documents and Settings\\HSNUboy\\����\\IFEFFITanalysis\\Mg3V2O8\\files.dat','data','data0','paths.dat','C:\\Documents and Settings\\HSNUboy\\����\\IFEFFITanalysis\\Mg3V2O8\\paths.dat','feff.inp','C:\\Documents and Settings\\HSNUboy\\����\\IFEFFITanalysis\\Mg3V2O8\\feff.inp','type','feff','lab','FEFF0','do_k',1,'do_q',1,'line',0,'do_r',1,'misc.dat','C:\\Documents and Settings\\HSNUboy\\����\\IFEFFITanalysis\\Mg3V2O8\\misc.dat','id','data0.feff0','edge','K'); [record] $old_path = 'data0.feff0.0'; @args = ('phase_array','','parent','data0.feff0','feff','feff0001.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0001.dat','s02','amp','do_k',1,'4th','','include',1,'reff','1.6949','delr','delr','amp_array','','sigma^2','ss1','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.0','file','feff0001.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 1.6949 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' -1.3783 -0.0264 -0.9861 3 8 O '); [record] $old_path = 'data0.feff0.1'; @args = ('phase_array','','parent','data0.feff0','feff','feff0002.dat','deg',1,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0002.dat','s02','amp','do_k',1,'4th','','include',1,'reff','1.7162','delr','delr','amp_array','','sigma^2','ss1','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.1','file','feff0002.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 1.7162 degeneracy = 1','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 1.4694 0.8867 3 8 O '); [record] $old_path = 'data0.feff0.2'; @args = ('phase_array','','parent','data0.feff0','feff','feff0003.dat','deg',1,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0003.dat','s02','amp','do_k',1,'4th','','include',1,'reff','1.8092','delr','delr','amp_array','','sigma^2','ss1','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.2','file','feff0003.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 1.8092 degeneracy = 1','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 -1.4185 1.1230 3 8 O '); [record] $old_path = 'data0.feff0.3'; @args = ('phase_array','','parent','data0.feff0','feff','feff0004.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0004.dat','s02','amp','do_k',1,'4th','','include','','reff','3.0732','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','3','do_r',1,'k_array','','id','data0.feff0.3','file','feff0004.dat','e0','e0','edge','K'); @strings = (' 3 legs Reff = 3.0732 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 1.3783 -0.0264 -0.9861 3 8 O ',' -1.3783 -0.0264 -0.9861 3 8 O '); [record] $old_path = 'data0.feff0.4'; @args = ('phase_array','','parent','data0.feff0','feff','feff0005.dat','deg',4,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0005.dat','s02','amp','do_k',1,'4th','','include','','reff','3.0880','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','3','do_r',1,'k_array','','id','data0.feff0.4','file','feff0005.dat','e0','e0','edge','K'); @strings = (' 3 legs Reff = 3.0880 degeneracy = 4','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 1.4694 0.8867 3 8 O ',' -1.3783 -0.0264 -0.9861 3 8 O '); [record] $old_path = 'data0.feff0.5'; @args = ('phase_array','','parent','data0.feff0','feff','feff0006.dat','deg',4,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0006.dat','s02','amp','do_k',1,'4th','','include','','reff','3.1913','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','3','do_r',1,'k_array','','id','data0.feff0.5','file','feff0006.dat','e0','e0','edge','K'); @strings = (' 3 legs Reff = 3.1913 degeneracy = 4','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 -1.4185 1.1230 3 8 O ',' -1.3783 -0.0264 -0.9861 3 8 O '); [record] $old_path = 'data0.feff0.6'; @args = ('phase_array','','parent','data0.feff0','feff','feff0007.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0007.dat','s02','amp','do_k',1,'4th','','include','','reff','3.2114','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','3','do_r',1,'k_array','','id','data0.feff0.6','file','feff0007.dat','e0','e0','edge','K'); @strings = (' 3 legs Reff = 3.2114 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 -1.4185 1.1230 3 8 O ',' 0.0000 1.4694 0.8867 3 8 O '); [record] $old_path = 'data0.feff0.7'; @args = ('phase_array','','parent','data0.feff0','feff','feff0008.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0008.dat','s02','amp','do_k',1,'4th','','include','1','reff','3.2223','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.7','file','feff0008.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 3.2223 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' -1.3783 -2.7247 -1.0294 3 8 O '); [record] $old_path = 'data0.feff0.8'; @args = ('phase_array','','parent','data0.feff0','feff','feff0009.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0009.dat','s02','amp','do_k',1,'4th','','include','1','reff','3.3566','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.8','file','feff0009.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 3.3566 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 1.5132 2.7968 1.0747 1 12 Mg '); [record] $old_path = 'data0.feff0.9'; @args = ('phase_array','','parent','data0.feff0','feff','feff0010.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0010.dat','s02','amp','do_k',1,'4th','','include','','reff','3.3898','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','4','do_r',1,'k_array','','id','data0.feff0.9','file','feff0010.dat','e0','e0','edge','K'); @strings = (' 4 legs Reff = 3.3898 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 1.3783 -0.0264 -0.9861 3 8 O ',' 0.0000 0.0000 0.0000 0 23 V ',' 1.3783 -0.0264 -0.9861 3 8 O '); [record] $old_path = 'data0.feff0.10'; @args = ('phase_array','','parent','data0.feff0','feff','feff0011.dat','deg',1,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0011.dat','s02','amp','do_k',1,'4th','','include','1','reff','3.4104','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.10','file','feff0011.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 3.4104 degeneracy = 1','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 -2.7511 -2.0155 2 23 V '); [record] $old_path = 'data0.feff0.11'; @args = ('phase_array','','parent','data0.feff0','feff','feff0012.dat','deg',1,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0012.dat','s02','amp','do_k',1,'4th','','include','1','reff','3.4098','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.11','file','feff0012.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 3.4098 degeneracy = 1','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 -1.3326 -3.1386 3 8 O '); [record] $old_path = 'data0.feff0.12'; @args = ('phase_array','','parent','data0.feff0','feff','feff0013.dat','deg',4,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0013.dat','s02','amp','do_k',1,'4th','','include','','reff','3.4111','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','4','do_r',1,'k_array','','id','data0.feff0.12','file','feff0013.dat','e0','e0','edge','K'); @strings = (' 4 legs Reff = 3.4111 degeneracy = 4','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 1.4694 0.8867 3 8 O ',' 0.0000 0.0000 0.0000 0 23 V ',' 1.3783 -0.0264 -0.9861 3 8 O '); [record] $old_path = 'data0.feff0.13'; @args = ('phase_array','','parent','data0.feff0','feff','feff0014.dat','deg',1,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0014.dat','s02','amp','do_k',1,'4th','','include','','reff','3.4323','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','4','do_r',1,'k_array','','id','data0.feff0.13','file','feff0014.dat','e0','e0','edge','K'); @strings = (' 4 legs Reff = 3.4323 degeneracy = 1','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 1.4694 0.8867 3 8 O ',' 0.0000 0.0000 0.0000 0 23 V ',' 0.0000 1.4694 0.8867 3 8 O '); [record] $old_path = 'data0.feff0.14'; @args = ('phase_array','','parent','data0.feff0','feff','feff0015.dat','deg',1,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0015.dat','s02','amp','do_k',1,'4th','','include','1','reff','3.4439','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.14','file','feff0015.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 3.4439 degeneracy = 1','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 -1.3756 3.1572 1 12 Mg '); [record] $old_path = 'data0.feff0.15'; @args = ('phase_array','','parent','data0.feff0','feff','feff0016.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0016.dat','s02','amp','do_k',1,'4th','','include','1','reff','3.4452','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.15','file','feff0016.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 3.4452 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 1.5132 0.1731 -3.0903 1 12 Mg '); [record] $old_path = 'data0.feff0.16'; @args = ('phase_array','','parent','data0.feff0','feff','feff0017.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0017.dat','s02','amp','do_k',1,'4th','','include','1','reff','3.4635','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.16','file','feff0017.dat','e0','e0','edge','K'); 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@strings = (' 2 legs Reff = 3.4965 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 3.0265 -1.4185 1.0264 3 8 O '); [record] $old_path = 'data0.feff0.19'; @args = ('phase_array','','parent','data0.feff0','feff','feff0020.dat','deg',4,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0020.dat','s02','amp','do_k',1,'4th','','include',0,'reff','3.5041','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','4','do_r',1,'k_array','','id','data0.feff0.19','file','feff0020.dat','e0','e0','edge','K'); @strings = (' 4 legs Reff = 3.5041 degeneracy = 4','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 -1.4185 1.1230 3 8 O ',' 0.0000 0.0000 0.0000 0 23 V ',' -1.3783 -0.0264 -0.9861 3 8 O '); [record] $old_path = 'data0.feff0.20'; @args = ('phase_array','','parent','data0.feff0','feff','feff0021.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0021.dat','s02','amp','do_k',1,'4th','','include','1','reff','3.5425','delr','delr','amp_array','','sigma^2','ss2','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.20','file','feff0021.dat','e0','e0','edge','K'); 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@strings = (' 2 legs Reff = 6.8818 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 3.0265 0.0000 -6.1805 2 23 V '); [record] $old_path = 'data0.feff0.305'; @args = ('phase_array','','parent','data0.feff0','feff','feff0431.dat','deg',4,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0431.dat','s02','amp','do_k',1,'4th','','include',0,'reff','6.8861','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','3','do_r',1,'k_array','','id','data0.feff0.305','file','feff0431.dat','e0','e0','edge','K'); @strings = (' 3 legs Reff = 6.8861 degeneracy = 4','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 3.0265 0.0000 -6.1805 2 23 V ',' 1.5132 0.1731 -3.0903 1 12 Mg '); [record] $old_path = 'data0.feff0.306'; @args = ('phase_array','','parent','data0.feff0','feff','feff0438.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0438.dat','s02','amp','do_k',1,'4th','','include',0,'reff','6.8982','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','3','do_r',1,'k_array','','id','data0.feff0.306','file','feff0438.dat','e0','e0','edge','K'); @strings = (' 3 legs Reff = 6.8982 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 4.3883 5.2881 3 8 O ',' 0.0000 2.9699 4.1650 2 23 V '); [record] $old_path = 'data0.feff0.307'; @args = ('phase_array','','parent','data0.feff0','feff','feff0444.dat','deg',4,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0444.dat','s02','amp','do_k',1,'4th','','include',0,'reff','6.9226','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','5','do_r',1,'k_array','','id','data0.feff0.307','file','feff0444.dat','e0','e0','edge','K'); @strings = (' 5 legs Reff = 6.9226 degeneracy = 4','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 1.3783 -0.0264 -0.9861 3 8 O ',' 0.0000 0.0000 0.0000 0 23 V ',' -3.0265 1.4694 1.2628 3 8 O ',' 1.3783 -0.0264 -0.9861 3 8 O '); [record] $old_path = 'data0.feff0.308'; @args = ('phase_array','','parent','data0.feff0','feff','feff0452.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0452.dat','s02','amp','do_k',1,'4th','','include',0,'reff','6.9476','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.308','file','feff0452.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 6.9476 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 6.0530 -2.7511 -2.0155 2 23 V '); [record] $old_path = 'data0.feff0.309'; @args = ('phase_array','','parent','data0.feff0','feff','feff0453.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0453.dat','s02','amp','do_k',1,'4th','','include',0,'reff','6.9473','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','2','do_r',1,'k_array','','id','data0.feff0.309','file','feff0453.dat','e0','e0','edge','K'); @strings = (' 2 legs Reff = 6.9473 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 6.0530 -1.3326 -3.1386 3 8 O '); [record] $old_path = 'data0.feff0.310'; @args = ('phase_array','','parent','data0.feff0','feff','feff0454.dat','deg',4,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0454.dat','s02','amp','do_k',1,'4th','','include',0,'reff','6.9476','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','3','do_r',1,'k_array','','id','data0.feff0.310','file','feff0454.dat','e0','e0','edge','K'); @strings = (' 3 legs Reff = 6.9476 degeneracy = 4','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' -6.0530 -2.7511 -2.0155 2 23 V ',' -3.0265 -1.3756 -1.0078 1 12 Mg '); [record] $old_path = 'data0.feff0.311'; @args = ('phase_array','','parent','data0.feff0','feff','feff0459.dat','deg',2,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0459.dat','s02','amp','do_k',1,'4th','','include',0,'reff','6.9611','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','4','do_r',1,'k_array','','id','data0.feff0.311','file','feff0459.dat','e0','e0','edge','K'); @strings = (' 4 legs Reff = 6.9611 degeneracy = 2','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 0.0000 2.9699 4.1650 2 23 V ',' 0.0000 4.3883 5.2881 3 8 O ',' 0.0000 1.4694 0.8867 3 8 O '); [record] $old_path = 'data0.feff0.312'; @args = ('phase_array','','parent','data0.feff0','feff','feff0465.dat','deg',4,'data','data0','3rd','','dphase','','label','','element','23','type','path','lab','feff0465.dat','s02','amp','do_k',1,'4th','','include',0,'reff','6.9760','delr','delr','amp_array','','sigma^2','ss','do_q',1,'ei','','line',0,'nleg','3','do_r',1,'k_array','','id','data0.feff0.312','file','feff0465.dat','e0','e0','edge','K'); @strings = (' 3 legs Reff = 6.9760 degeneracy = 4','',' x y z pot at#',' 0.0000 0.0000 0.0000 0 23 V',' 6.0530 -1.3326 -3.1386 3 8 O ',' 1.3783 -0.0264 -0.9861 3 8 O '); [record] @journal = (); 1; # Local Variables: # truncate-lines: t # End: