[Pw_forum] Mg and O pseudo potential
asaaravindh at yahoo.co.in
Mon Nov 3 14:29:42 CET 2008
I want to do calculations on Fe/MgO/Fe system.. and I found that the pseudo potential Fe.pbe-nd-rrkjus.UPF
is apropriate as far af Fe is concerned. But I couldnt find any similar pp for Mg and O.
Can anybody give me some information regarding this. Is there any such pp availale for Mg and O or any other common pp for Fe , Mg and O
any help would be greatly appreciated.
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