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by wlyim
Wed Jul 20, 2011 6:50 am
Forum: Ground state
Topic: Fermi energy from NSCF calcuations
Replies: 0
Views: 1448

Fermi energy from NSCF calcuations

Dear Sir/Madam, May I ask how I can get the Fermi energy from the NSCF calculations? I found that the Fermi energy was not converged when I used a looser k-mesh in SCF. I tried to run NSCF at denser k-mesh, but ABINIT doesn't print out the newer Fermi energy. Is it a limitation? Or how can I fix it?...