Dear Roc,
> So, the QE 6.6 does not support the "occupations= 'tetrahedra_opt',", right?
Right.
Greetings,
Iurii
--
Dr. Iurii TIMROV
Senior Research Scientist
Theory and Simulation of Materials (THEOS)
Swiss Federal Institute of Technology Lausanne (EPFL)
CH-1015 Lausanne, Switzerland
+41 21 69 34 881
http://people.epfl.ch/265334
From: users on behalf of 526587466
via users
Sent: Friday, July 30, 2021 12:30:55 PM
To: QEforum
Subject: [QE-users] HP with tetrahedra is not supported
Dear Sir,
When calculating the U value, it prints the error "HP with tetrahedra is not
supported". So, the QE 6.6 does not support the "occupations=
'tetrahedra_opt',", right?
Thanks.
Best,
Roc
HTU
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