[QE-users] Different SCF energy when # of MPI is changed
KRISHNENDU MUKHERJEE
krishnendu at nmlindia.org
Wed Oct 19 12:42:32 CEST 2022
Dear Takahiro Chiba,
Isn't that the degauss value should be in between 0.01 to 0.02 Rydberg. That is mentioned by Nicola Marzari in his lecture.
Regards,
Krishnendu
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