[CPMD-list] Question about Pd usp pseudopotential

baki at chemres.hu baki at chemres.hu
Wed Sep 18 10:24:06 CEST 2002


Dear Everybody
Have somebody some suggestion how can I generated USP pseudopotential for
Pd. I have already tried to use the new version of USp-7-3.4 but I can not
make  all electron calculation for this  element (For O,Cu and any other
works well)
Best
Imre
Bakó Imre
MTA Kémiai Kutatóközpont, Kémiai Intézet
1525 Budapest Pf. 17
Telefon 



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