On 14/02/2025 12:35, Johnson, Miles R. wrote:
Oops, not new to it at this point just misread the docs 😬 unfortunately
SOC is necessary for what im trying to do.
You might still want to make sure you are able to do a collinear
calculation first.
nicola
--
----------------------------------------------------------------------
Prof Nicola Marzari, Chair of Theory and Simulation of Materials, EPFL
Director, National Centre for Competence in Research NCCR MARVEL, SNSF
Laboratory Head, PSI Center for Scientific Computing, Theory, and Data
Contact info and websites at http://theossrv1.epfl.ch/Main/Contact
_______________________________________________________________________________
The Quantum ESPRESSO Foundation stands in solidarity with all civilians
worldwide who are victims of terrorism, military aggression, and indiscriminate
warfare.
--------------------------------------------------------------------------------
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
