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[abinit-forum] k-points for bandstructure


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  • From: Anurag Chaudhry <anuragchaudhry@yahoo.co.uk>
  • To: forum@abinit.org
  • Subject: [abinit-forum] k-points for bandstructure
  • Date: Sun, 15 Feb 2009 07:55:25 +0000 (GMT)
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Hello Everyone,

I was reading the documentation for the bandstructure maker utility for ABINIT.  The explanation is very useful.

However I would like to know of a web resource (or any other source like book, ...) to know the special k-points to chose for a bandstructure plot for any given crystal space group.

For some well known space groups it is very easy to find the "special k-points" however for something like space group 148 (R-3H) of YI3 how to choose the reciprocal space k-points and the spacing between them.

any suggestions are very much appreciated.

best regards,
Anurag




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