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- From: Bohdan Andriyevsky <bandri@tu.koszalin.pl>
- To: forum@abinit.org
- Subject: input of crystal structure
- Date: Wed, 19 Jan 2005 14:15:27 +0100
Dear ABINITians,
The structure of my crystal is monoclinic (7 or Pc group of symmetry). I have the fractional coordinates of source atoms and two symmetry operations: x,y,z and 1/2x,-y,z. How I have to construct the geometric part of the ABINIT input to include these data?
Thanks in advance for your reply,
Bohdan
- input of crystal structure, Bohdan Andriyevsky, 01/19/2005
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