ML LAFILT2: Difference between revisions
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Description: This tag specifies whether angular filtering is applied or not within the machine learning force field method. | Description: This tag specifies whether angular filtering is applied or not within the machine learning force field method. | ||
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The applied angular filter is described [[On-the-fly machine learning force field generation using Bayesian linear regression#Basis set expansion|here]]. | |||
== Related Tags and Sections == | == Related Tags and Sections == | ||
Revision as of 10:25, 16 July 2019
ML_FF_LAFILT2_MB = [logical]
Default: ML_FF_LAFILT2_MB = .FALSE.
Description: This tag specifies whether angular filtering is applied or not within the machine learning force field method.
The applied angular filter is described here.
Related Tags and Sections
ML_FF_LMLFF, ML_FF_IAFILT2_MB, ML_FF_AFILT2_MB