[QE-users] ibrave=-12

Paolo Giannozzi paolo.giannozzi at uniud.it
Sat Mar 16 21:07:35 CET 2024


On 16/03/2024 11:49, Fariba Nazari via users wrote:
> ​Dear all,
> 
> Does crystal_b work for ibrave=-12?

for "ibrave"=-12, no. For "ibrav"=-12, it should work

Paolo

> Best Regards
> Fariba Nazari
> IASBS
> 
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-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 206, 33100 Udine Italy, +39-0432-558216


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