[CPMD-list] Goedecker psudopotential cutoffs
Audrius Alkauskas
audrius.alkauskas at unibas.ch
Mon Dec 2 14:59:23 CET 2002
Sorry for previous incorrect mail.
Dear all
1. What are recommended cutoffs with Goedecker LDA pseudopotentials for: Ag
(silver), B (boron), Cl (chlorine), N (nitrogen), C (carbon), H (hydrogen)?
2. I am doing now silver cluster intracting with big molecule. Is it wise to
use finite-temperature methods for just 4 silver atoms?
Audrius
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