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Re: [abinit-forum] kptopt=3

From: Matthieu Verstraete <mjv500@york.ac.uk>
To: forum@abinit.org
Subject: Re: [abinit-forum] kptopt=3
Date: Tue, 24 Jul 2007 08:44:17 +0100 (BST)

kptopt 3 still uses the (inalterable) time reversal symmetry. As long as you don't add a magnetic field, you can reduce nkpt by about half.

M.

--
================================================================
Dr. Matthieu Verstraete mailto:mjv500@york.ac.uk
Dept. of Physics, University of York, tel: +44 1904 43 22 08
Heslington, YO10 5DD York, United Kingdom fax: +44 1904 43 22 14

Different nkpt, zyg, 07/04/2007
- Re: [abinit-forum] Different nkpt, Matthieu Verstraete, 07/04/2007
  - Re: Re: [abinit-forum] Different nkpt, zyg, 07/09/2007
    - Re: Re: [abinit-forum] Different nkpt, Matthieu Verstraete, 07/11/2007
  - kptopt=3, zyg, 07/24/2007
    - Re: [abinit-forum] kptopt=3, Matthieu Verstraete, 07/24/2007