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Difference between revisions of "ML FF SIGV0 MB"

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[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category:VASP6]]
[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]]

Revision as of 11:04, 30 January 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.

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