[Wien] Mixer error: NEC01 charge leakage too large
Lyudmila Dobysheva
lyuka17 at mail.ru
Wed Nov 3 13:30:46 CET 2021
03.11.2021 03:43, ChenJie wrote:
> I read from the manual that this issue could be caused by improper
> setting of RMT, or the energy to separate core from valence states
The third reason is often encountered: wrong lattice parameters if
Angstroms and a.u. are confused.
Best wishes
--
Lyudmila Dobysheva
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