[Pw_forum] charge density difference 1

wangqj1 wangqj1 at 126.com
Wed Jun 4 08:17:36 CEST 2008


 Thanks for your advice about charge density difference .
 but I still have a problem :
 whether I get the filepp(1)='ZnOcharge',filepp(2)='ZnOcharge',filepp(3)='Ocharge'in one 'scf' or I must do them seperately (i.e,three times) ?
thank you !

 
 
 
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