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cu_111_surface_and_k-points_sampling [2015/05/29 07:56]
krejcio
cu_111_surface_and_k-points_sampling [2015/05/29 08:11] (current)
krejcio
Line 92: Line 92:
  iquench = -6    ! -1 = MDmin, -6 = FIRE optimization   iquench = -6    ! -1 = MDmin, -6 = FIRE optimization
  icluster = 0   icluster = 0
-  iqout = 3+  iqout = 1
  dt = 0.5   dt = 0.5
  &END   &END
 
cu_111_surface_and_k-points_sampling.txt · Last modified: 2015/05/29 08:11 by krejcio
 
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