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Re: [abinit-forum] special point


Chronological Thread 
  • From: Xavier Gonze <xavier.gonze@uclouvain.be>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] special point
  • Date: Fri, 29 May 2009 18:18:16 +0200

Dear mourad,

For GaAs, these are given explicitly in
http://www.abinit.org/documentation/helpfiles/for-v5.8/input_variables/vargs.html#kptbounds
see section A. FCC lattice

Best,
Xavier

On 29 May 2009, at 17:13, mourad wrote:

when i want to draw for example the band sructure of GaAs I need typical
circuit in the BZ and the coordinates of sevral special points.
how can i do to calculate the coordinates of these special points.




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