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<p class=MsoNormal><font size=1 face=Arial><span lang=EN-US style='font-size:
9.0pt;font-family:Arial'>WIEN2k users:<o:p></o:p></span></font></p>
<p class=MsoNormal><font size=1 face=Arial><span lang=EN-US style='font-size:
9.0pt;font-family:Arial'> When calculating
the material which structure is same as LaMnO3, I encounter some problems. <o:p></o:p></span></font></p>
<p class=MsoNormal style='text-indent:31.5pt'><font size=1 face=Arial><span
lang=EN-US style='font-size:9.0pt;font-family:Arial'>The d-charge is splitted
into eg and t<st1:chmetcnv TCSC="0" NumberType="1" Negative="False"
HasSpace="False" SourceValue="2" UnitName="g" w:st="on">2g</st1:chmetcnv> according
to cubic symmetry. In SCF file I just get D-x2y2 and D-z2 charge number.<o:p></o:p></span></font></p>
<p class=MsoNormal style='text-indent:31.5pt'><font size=1 face=Arial><span
lang=EN-US style='font-size:9.0pt;font-family:Arial'>Can I change the charge
number in D-x2y2 and D-z2? And how to do it?<o:p></o:p></span></font></p>
<p class=MsoNormal><font size=1 face=Arial><span lang=EN-US style='font-size:
9.0pt;font-family:Arial'> Thank you very much.<o:p></o:p></span></font></p>
<p class=MsoNormal><font size=1 face=Arial><span lang=EN-US style='font-size:
9.0pt;font-family:Arial'><o:p> </o:p></span></font></p>
<p class=MsoNormal><font size=1 face=Arial><span lang=EN-US style='font-size:
9.0pt;font-family:Arial'>Beat regard<o:p></o:p></span></font></p>
<p class=MsoNormal><font size=1 face=Arial><span lang=EN-US style='font-size:
9.0pt;font-family:Arial'><o:p> </o:p></span></font></p>
<p class=MsoNormal><font size=1 face=Arial><span lang=EN-US style='font-size:
9.0pt;font-family:Arial'>Kong<o:p></o:p></span></font></p>
<p class=MsoNormal><font size=1 face=Arial><span lang=EN-US style='font-size:
9.0pt;font-family:Arial'><o:p> </o:p></span></font></p>
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