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 [math]\displaystyle{ \frac{1}{\sigma_{\mathrm{v}}^{2}} }[/math] in the machine learning force field method.
For the optimization of the optimization of the reverse and squared noise parameter [math]\displaystyle{ \frac{1}{\sigma_{\mathrm{v}}^{2}} }[/math] see following section: Machine learning force field: Theory.
Related Tags and Sections
ML_FF_LMLFF, ML_FF_IREG_MB, ML_FF_SIGW0_MB