[Pw_forum] gamma_only and noncolin not allowed

[Paolo Giannozzi]

On Mon, 2014-06-23 at 16:35 +0200, Valentina Cantatore wrote:

> I need gamma_only option for the further calculations. Is there a way
> to conciliate gamma_only and noncolin?

If the further calculations explicitly need Gamma-specific tricks 
(sure?): no. If however you just need to use k=0 in the noncolinear
case, without Gamma-specific tricks (such as storing just half of 
the plane waves because the wavefunctions are real), then
 
K_POINTS tpiba
1
0.0 0.0 0.0  1.0

will do the job

P.

> Thank you very much for the answer.
> 
> 
> Valentina Cantatore
> PostDoc Researcher - Università del Piemonte Orientale (Alessandria,
> Italy)
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-- 
 Paolo Giannozzi, Dept. Chemistry&Physics&Environment, 
 Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
 Phone +39-0432-558216, fax +39-0432-558222