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beauty:variables [2018/06/20 21:54] – [Propositions] Xavier Gonzebeauty:variables [2018/06/20 22:11] (current) – [To be clarified] Xavier Gonze
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 cpuh, cpum, cpus => should'nt we use INPUT_ONLY and NO_MULTI both for all three variables? cpuh, cpum, cpus => should'nt we use INPUT_ONLY and NO_MULTI both for all three variables?
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-diecut => Check if the modif is correct in diecut : originally found => (1/2)[(2 Pi)*(Gmax)]  2  =[[ecut]]  
  
 diecut/diegap => should we incorporate only relevant if iprcel >=21 as in dielam? diecut/diegap => should we incorporate only relevant if iprcel >=21 as in dielam?
  
-kptbounds => personal remark : a big part of the describtion should be moved in another place of the website (kind of tutorial somehow).+kptbounds => personal remark : a big part of the description should be moved in another place of the website (kind of tutorial somehow).
  
 occ => not sure if the dimension given in the description is correct (as it does not seem to correspond to the text). occ => not sure if the dimension given in the description is correct (as it does not seem to correspond to the text).
beauty/variables.1529524459.txt.gz · Last modified: 2018/06/20 21:54 by Xavier Gonze