ML AFILT2: Difference between revisions
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{{DISPLAYTITLE:ML_AFILT2}} | |||
{{TAGDEF|ML_AFILT2|[real]|0.002}} | {{TAGDEF|ML_AFILT2|[real]|0.002}} | ||
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== Related | == Related tags and articles == | ||
{{TAG|ML_LMLFF}}, {{TAG|ML_LAFILT2}}, {{TAG|ML_IAFILT2}} | {{TAG|ML_LMLFF}}, {{TAG|ML_LAFILT2}}, {{TAG|ML_IAFILT2}} | ||
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[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category: Alpha]] | [[Category:INCAR tags]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category: Alpha]] | ||
Revision as of 17:12, 6 April 2022
ML_AFILT2 = [real]
Default: ML_AFILT2 = 0.002
Description: This tag sets the filtering parameter for the angular filtering for ML_IAFILT2 in the machine learning force field method.
This tag is only used if ML_LAFILT2=.TRUE. and ML_IAFILT2=2 are used.
The angular filtering function[1] for ML_IAFILT2=2 is described as . The tag ML_AFILT2 sets the parameter .
![\eta _{{l,a_{{{\mathrm {FILT}}}}}}={\frac {1}{1+a_{{{\mathrm {FILT}}}}[l(l+1)]^{{2}}}}](https://www.vasp.at/wiki/restbase/vasp.at/v1/media/math/render/svg/c667f6e9ea6c819e649a9f54c0732ee2835a3295)
References
Related tags and articles
ML_LMLFF, ML_LAFILT2, ML_IAFILT2