[QE-users] How use virtual_v2.x to obtain a mixed pseudopotential to Mo and W atoms?

Alysson Alves Pinto alysson.pinto at lnnano.cnpem.br
Wed Aug 2 16:28:43 CEST 2023


I've been trying extensively to create a mixed pseudopotential via the virtual crystal approximation (VCA) by combining the Mo and W pseudopotentials. Does anyone have any ideas?
Thanks in advance.


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