forum@abinit.org

Subject: The ABINIT Users Mailing List ( CLOSED )

List archive

A question about Non-collinear magnetism calculation and symmetry

From: Xinjie Wang <xinjie@physics.rutgers.edu>
To: forum@abinit.org
Subject: A question about Non-collinear magnetism calculation and symmetry
Date: Thu, 07 Apr 2005 15:59:08 -0400

Dear, all

I am doing non-collinear magnetism calculation of BCC Fe with spin-orbit coupling (nspden=4, spinor=2).
Abinit requires turnning off all symmetries. The computational time increases by 48 times! I am wondering
if Abinit can identify the magnetic space group and if there is a way to retain the symmetries in non-collinear
magnetism calculation. Many thanks in advance!

Best,
Xinjie

A question about Non-collinear magnetism calculation and symmetry, Xinjie Wang, 04/07/2005
- Re: [abinit-forum] A question about Non-collinear magnetism calculation and symmetry, Gilles Zerah, 04/11/2005
- Re: [abinit-forum] A question about Non-collinear magnetism calculation and symmetry, Xavier Gonze, 04/12/2005
  - Info/question for Mac OS X users, David M. Wood, 04/14/2005
    - Message not available
      - Re: [abinit-forum] Info/question for Mac OS X users, Masayoshi Mikami, 04/15/2005