[QE-users] HP with tetrahedra is not supported

2021-07-30 Thread 526587466 via users 






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,RocHTU






 










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Re: [QE-users] HP with tetrahedra is not supported

2021-07-30 Thread Iurii TIMROV via users 
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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