Re: [QE-users] ibrave=-12

2024-03-16 Thread Paolo Giannozzi

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
___
The Quantum ESPRESSO community stands by the Ukrainian
people and expresses its concerns about the devastating
effects that the Russian military offensive has on their
country and on the free and peaceful scientific, cultural,
and economic cooperation amongst peoples
___
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
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[QE-users] ibrave=-12

2024-03-16 Thread Fariba Nazari via users
​Dear all,
Does crystal_b wok for ibrave=-12?
Best Regards
Fariba Nazari
IASBS
___
The Quantum ESPRESSO community stands by the Ukrainian
people and expresses its concerns about the devastating
effects that the Russian military offensive has on their
country and on the free and peaceful scientific, cultural,
and economic cooperation amongst peoples
___
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
https://lists.quantum-espresso.org/mailman/listinfo/users