ML MHIS

From VASP Wiki
Revision as of 11:00, 30 January 2020 by Karsai (talk | contribs)

ML_FF_MHIS = [integer]
Default: ML_FF_MHIS = 10 

Description: This flag sets the number of estimated errors stored in memory to determine the threshold for the Bayesian error in the machine learning force field method.


This flag is only used if ML_FF_LCRITERIA=.TRUE. is set.

Related Tags and Sections

ML_FF_LMLFF, ML_FF_LCRITERIA, ML_FF_CTIFOR

Examples that use this tag