[Pw_forum] question

Lorenzo Paulatto paulatz at gmail.com
Tue Oct 24 11:39:09 CEST 2017

On 24/10/17 10:55, Giuseppe Mattioli wrote:
> Yes, you can perform calculations at variable pressure, look at this
> example in the QE distribution
I would add that including temperature-dependent volume treatment by 
quasi-harmonic approximation or better is probably necessary to have 
something meaningful

Lorenzo Paulatto - Paris

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