ML_SIGW0

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Revision as of 20:47, 26 April 2023 by Karsai (talk | contribs)

{{TAGDEF|ML_SIGW0|[real]|}

Default: ML_SIGW0 = 1E-7 for ML_MODE = REFIT
= 1.0 else

Description: This flag sets the initial reversed and squared precision parameter [math]\displaystyle{ \frac{1}{\sigma_{\mathrm{w}}^{2}} }[/math] in the machine learning force field method.


For details about the optimization of this regularization parameter see this section.

Related tags and articles

ML_LMLFF, ML_MODE, ML_IREG, ML_SIGV0

Examples that use this tag