ML SIGV0: Difference between revisions
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For the optimization of the optimization of the reverse and squared noise parameter <math>\frac{1}{\sigma_{\mathrm{v}}^{2}}</math> see following section: | For the optimization of the optimization of the reverse and squared noise parameter <math>\frac{1}{\sigma_{\mathrm{v}}^{2}}</math> see following section: | ||
[[Machine learning force field: Theory]]. | |||
== Related Tags and Sections == | == Related Tags and Sections == | ||
Revision as of 08:41, 8 June 2021
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: Machine learning force field: Theory.
Related Tags and Sections
ML_FF_LMLFF, ML_FF_IREG_MB, ML_FF_SIGW0_MB