[Wien] Whether there would be energy difference between k point sampling via 2x2x3 & 3x2x2?

Laurence Marks laurence.marks at gmail.com
Fri Aug 25 13:13:26 CEST 2023


Yes, there will be in general.

--
Professor Laurence Marks (Laurie)
Walter P Murphy Professor Emeritus
Department of Materials Science and Engineering, Northwestern University
www.numis.northwestern.edu
"Research is to see what everybody else has seen, and to think what nobody
else has thought" Albert Szent-Györgyi

On Fri, Aug 25, 2023, 05:46 shamik chakrabarti <shamik15041981 at gmail.com>
wrote:

> Dear Wien2k users,
>
>                          I have a basic question.
> Whether there would be energy difference between k point sampling via
> 2x2x3 & 3x2x2?
>
> Looking forward to your reply.
>
> witty regards,
> --
> Dr. Shamik Chakrabarti
> Research Fellow
> Department of Physics
> Indian Institute of Technology Patna
> Bihta-801103
> Patna
> Bihar, India
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