ML SIGV0: Difference between revisions

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{{TAGDEF|ML_SIGV0|[real]|1.0}}
{{TAGDEF|ML_SIGV0|[real]|1.0}}


Description: This flag sets the noise parameter <math>s_{\sigma_{\mathrm{v}}}</math> in the machine learning force field method.
Description: This flag sets the noise parameter <math>s_{\mathrm{v}}</math> for the fitting in the machine learning force field method.
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For details about the optimization of this regularization parameter see [[Machine learning force field: Theory#Bayesian error estimation|this section]].
For details about the optimization of this regularization parameter see [[Machine learning force field: Theory#Bayesian error estimation|this section]].

Revision as of 15:38, 3 July 2023

ML_SIGV0 = [real]
Default: ML_SIGV0 = 1.0 

Description: This flag sets the noise parameter for the fitting in the machine learning force field method.


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

Related tags and sections

ML_LMLFF, ML_IREG, ML_SIGW0

Examples that use this tag