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

Difference between revisions of "ML FF SIGV0 MB"

From Vaspwiki
Jump to navigationJump to search
Line 12: Line 12:
[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]]
[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category: Alpha]]

Latest revision as of 15:22, 29 February 2020

ML_FF_SIGV0_MB = [real]
Default: ML_FF_SIGV0_MB = 1.0 

Description: This flag sets the initial reversed and squared noise parameter in the machine learning force field method.

For the optimization of the optimization of the reverse and squared noise parameter see following section: On-the-fly machine learning force field generation using Bayesian linear regression.

Related Tags and Sections


Examples that use this tag