ML SIGV0

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Revision as of 06:50, 23 August 2021 by Karsai (talk | contribs) (Karsai moved page ML FF SIGV0 MB to ML SIGV0)

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

Examples that use this tag