[Pw_forum] (Без темы)
Бадретдинов Данис
reason2205 at ya.ru
Mon Oct 27 17:41:12 CET 2014
Dear users of Quantum Espresso.
In my research I use pw2wannier for wannier90 to obtain hopping matrices in spin-orbit case. It is known that
in pw2wannier spinors and orbital magnetisation term are not yet implimented for ultrasofts or PAW pseudopotentials. So I can't find full-relativistic norm-conserving pseudopotential for copper. Does it really exist? Could somebody help me to find it?
I would be very thankfull for any help,
Best regards,
Danis.
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