[QE-users] starting charge on atomic type 'i'

Andrey Chibisov andreichibisov at yandex.ru
Mon Jul 30 07:42:07 CEST 2018


Hello.
In PWscf there is feature "starting_charge(i)" (-starting charge on atomic type 'i').
How I can manage this parameter?
What units has it got?


-- 
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
https://www.linkedin.com/in/andrey-chibisov-98625355/


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