[Pw_forum] ld1.x: Generate pseudo potential for Co

Duy Le ttduyle at gmail.com
Tue Aug 18 23:31:51 CEST 2009


Dear all,

I wonder if anyone has generated PBE (or any others) pseudo potential for Co
with including 3P (and/or 3S)? If you did, and if you don't mind to share,
please tell me some hints or just share the potential (input of ld1.x code
is good enough).

I've spend quite sometime to do this task, however, I always got the polite
message "Errors in PS-KS equation".

Any other suggestion is appreciated.

Best regards,
D.
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