[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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