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[abinit-forum] rprim


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  • From: Bahareh Malvandi <bahareh_malvandi@yahoo.com>
  • To: forum@abinit.org
  • Subject: [abinit-forum] rprim
  • Date: Fri, 18 Dec 2009 23:28:46 -0800 (PST)
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hi
could you help me to find rpim for rhombohedral structure or monoclinic?
xred
    0.2500  0.2500  0.2500     
    0.7500  0.7500  0.7500     
    0.0000  0.0000  0.0000    
    0.5000  0.5000  0.5000
    0.1982  0.3018  0.7500
    0.8018  0.6982  0.2500
    0.3018  0.7500  0.1982
    0.6982  0.2500  0.8018
    0.7500  0.1982  0.3018
    0.2500  0.8018  0.6982

angdeg    60.798  60.798  60.798

best regards





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