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Re: [abinit-forum] alpha boron structure


Chronological Thread 
  • From: SIBERCHICOT Bruno <bruno.siberchicot@cea.fr>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] alpha boron structure
  • Date: Mon, 18 Feb 2008 14:51:23 +0100
  • Organization: CEA-DAM

Hello,

I didn't try the crystal structure given in the website.
I'm using the classical structure of alpha boron given by B.F. Decker et al., Acta Cryst, 12, 503, (1959) with two Wyckoff positions BI (6h) and BII(6h). ABINIT gives the full group R-3m (166)
Bruno

bouhadda@yahoo.com a écrit :
dear abiniter
when i have use the crystal structure gived
in:http://cst-www.nrl.navy.mil/lattice/struk.xmol/alphaB.pos for alpha boron the output file give me a space group P2/m (# 10)
in other hand when i used the data of www.webelements.com
, ( (0.506Angstrom and 56.06degre i have the same problem. can somebody
help me ?
thank you





  • alpha boron structure, bouhadda, 02/14/2008
    • Re: [abinit-forum] alpha boron structure, SIBERCHICOT Bruno, 02/18/2008

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