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Difference between revisions of "ML FF SIGV0 MB"

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{{TAGDEF|ML_FF_SIGV0_MB|[real]|1.0}}
 
{{TAGDEF|ML_FF_SIGV0_MB|[real]|1.0}}
  
Description: This flag sets the noise parameter in the machine learning force field method.
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Description: This flag sets the initial noise parameter in the machine learning force field method.
 
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For the optimization of the noise parameter <math>\sigma_{\mathrm{v}}^{2}</math> see following section:
On-the-fly machine learning force field generation using Bayesian linear regression.
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{{TAG|On-the-fly machine learning force field generation using Bayesian linear regression}}.
  
 
== Related Tags and Sections ==
 
== Related Tags and Sections ==
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{{TAG|ML_FF_LMLFF}}, {{TAG|ML_FF_IREG_MB}}, ML_FF_SIGW0_MB
  
 
{{sc|ML_FF_SIGV0_MB|Examples|Examples that use this tag}}
 
{{sc|ML_FF_SIGV0_MB|Examples|Examples that use this tag}}
 
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[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]]
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[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category:VASP6]]

Revision as of 18:10, 19 May 2019

ML_FF_SIGV0_MB = [real]
Default: ML_FF_SIGV0_MB = 1.0 

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


For the optimization of the noise parameter see following section: On-the-fly machine learning force field generation using Bayesian linear regression.

Related Tags and Sections

ML_FF_LMLFF, ML_FF_IREG_MB, ML_FF_SIGW0_MB

Examples that use this tag