NSW: Difference between revisions
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{{sc|NSW|Examples|Examples that use this tag}} | {{sc|NSW|Examples|Examples that use this tag}} | ||
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[[Category:INCAR]][[Category:Structural Optimization]][[Category:Molecular Dynamics]][[Category:Ionic Minimization Methods]] | [[Category:INCAR]][[Category:Structural Optimization]][[Category:Molecular Dynamics]][[Category:Ionic Minimization Methods]] | ||
Revision as of 10:36, 19 April 2019
NSW = [integer]
Default: NSW = 0
Description: NSW sets the maximum number of ionic steps.
Mind: Within each ionic step at most NELM electronic-SC loops are performed unless the EDIFF convergence criterium is matched before. Exact Hellmann-Feynman forces and stresses are calculated for each ionic step.