[Pw_forum] Phonon of single layer MoS2

Paolo Giannozzi p.giannozzi at gmail.com
Mon Jul 13 21:31:50 CEST 2015


On Mon, Jul 13, 2015 at 8:59 PM, Shopping <pengjieusa at gmail.com> wrote:

choosing "Shopping" as name is a good way to end up in the spam folder.

&system

  ibrav= 0,
>     A=3.192,
>     nat=  3, ntyp= 2,
> /
>

cutoff?

Paolo
-- 
Paolo Giannozzi, Dept. Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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