[Pw_forum] How to analyze the result of pdos

wangqj1 wangqj1 at 126.com
Thu Sep 4 05:31:14 CEST 2008


 
 Dear all
      After I used projwfc.x ,I got the pdos of every atom ,but I don't know the signification of the following characters of pdos_atm#1(Zn)_wfc#1(d) and pdos_atm#1(Zn)_wfc#2(s).
 
 pdos_atm#1(Zn)_wfc#1(d):
# E (eV)  ldosup(E)  ldosdw(E) pdosup(E)  pdosdw(E)  pdosup(E)  pdosdw(E)  pdosup(E) pdosdw(E)  pdosup(E)  pdosdw(E)  pdosup(E)  pdosdw(E)  
 
pdos_atm#1(Zn)_wfc#2(ds):
# E (eV)  ldosup(E)  ldosdw(E) pdosup(E)  pdosdw(E)  

      Besides,I want to draw the figure of pdos of every atom on the same figure .for Zn3p,Zn4s,and so on .So what data should I extract from the pdos_atm#1(Zn)_wfc#1(d)and pdos_atm#1(Zn)_wfc#2(ds),for there are so many information .
     Any advice will be appreciated !
sincerely
 
XiangTan University 
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