[CPMD-list] Pseudopotential for Pd

Samir Mushrif s_mushrif at yahoo.com
Mon May 7 17:58:02 CEST 2007


Dear CPMD Users,
                              I want to run CPMD simulation for A system containing Pd-acetylacetonate [Pd(C5O2H7)2] and polyaromatic hydrocarbons. I am looking for pseudopotential for Pd. There is only one type of pseudopotential that I could get and that is the Goedecker PSP for LDA. Can someone help me find PSP for other functionals? I also could not find any other type of pseudopotential (like vdb etc.).
Thanks for your help.
Samir


 
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