[Pw_forum] troubleshooting cdiaghg-have checked faq

Sonu Kumar 1009ukumar at gmail.com
Tue Jan 8 12:28:59 CET 2013


On Tue, Jan 8, 2013 at 6:27 AM, vijaya subramanian <vijaya65 at hotmail.com>wrote:

>
> ATOMIC_SPECIES
> C 12.011 C.pbe-van_bm.UPF
> F 18.998 F.pbe-n-van.UPF
> H 1.00794  H.pbe-van_bm.UPF
>

Hi Vijaya,

Better you try with your own generated PPs or from pseudo
library http://qe-forge.org/gf/project/pslibrary/

Good Luck.

==========================================
Sonu Kumar
Senior Research Fellow,
Physics Department
Indian Institute of Technology, Delhi-110016, India
mail: 1009ukumar at gmail.com
web:-http://www.iitd.ac.in/
==========================================
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