[Pw_forum] The cell blowing up in MD simulation

Paolo Giannozzi giannozz at democritos.it
Wed Sep 26 19:31:14 CEST 2012

On Sep 26, 2012, at 19:19 , Tian Lan wrote:

> I cannot find the input card like &K_Points in cp.x, how could I  
> control the k sampling?

you cannot: CP uses Gamma-point (k=0) sampling only

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

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