[Pw_forum] ultrasoft pseudopotentials for Cs and I
Stefano Baroni
baroni at sissa.it
Sun Oct 15 07:31:06 CEST 2006
norm-conserving PP's are rather soft in this case because the cores
avery very large, even including semi-core states in the valence ...
SB
On Oct 15, 2006, at 4:51 AM, li yan wrote:
> deer all,
> Does anyone know where I can find the ultra-soft
> pseudopotentials for Cs and I ?
> best regards
>
> 抢注雅虎免费邮箱-3.5G容量,20M附件!
---
Stefano Baroni - SISSA & DEMOCRITOS National Simulation Center -
Trieste
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