[Wien] Convergence criterion

John Appleton banger_deep at yahoo.com
Fri Oct 20 17:09:56 CEST 2006


Dear user,
   
  I know that the convergence criterion for energy is 
  1/2 [|En - En-1| + |En - En-2|] where En is the 
   energy in the nth scf step.What is the criterion 
  used for force convergence?
   
  Thanks
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