[QE-users] P-doped Silicon+Electric Field+noncolin does not converge

Andrey Chibisov andreichibisov at yandex.ru
Tue May 22 11:17:59 CEST 2018

Dear Colleagues,
I try to find a 'scf' state for 'P-doped Silicon+Electric Field+noncolin' system.
But this system converge very slowly. Indeed, after 100 electronic cycles I can't find the convergence.
Please, help me. Were was I wrong?

Best regards,
Dr. Andrey Chibisov, Ph.D.
Senior Researcher,
Laboratory of Numerical Methods in Mathematical Physics,
Computational Centre of the Russian Academy of Sciences.
Khabarovsk, Russia
Web page: https://www.researchgate.net/profile/A_Chibisov
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