Requests for technical support from the VASP group should be posted in the VASP-forum.

Difference between revisions of "ML FF LCRITERIA"

From Vaspwiki
Jump to navigationJump to search
Line 7: Line 7:
== Related Tags and Sections ==
== Related Tags and Sections ==
{{sc|ML_FF_LCRITERIA|Examples|Examples that use this tag}}
{{sc|ML_FF_LCRITERIA|Examples|Examples that use this tag}}

Revision as of 08:36, 27 May 2019

ML_FF_LCRITERIA = [logical]

Description: Decides whether the threshold in the learning decision step for the Bayesian error estimation is renewed or not in the machine learning force field methods

This flag is only used if Bayesian error estimation is switched on (ML_FF_IERR=2 or 3).

Related Tags and Sections


Examples that use this tag