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Difference between revisions of "ML FF LBASIS DISCARD"

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[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[VASP6]]
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[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category:VASP6]]

Revision as of 15:48, 10 May 2019

ML_FF_LBASIS_DISCARD = [logical]
Default: ML_FF_LBASIS_DISCARD = .FALSE. 

Description: This variable specifies whether the basis sets are thrown away when its number exceeds ML_FF_MB_MB in the machine learning force field method.


Related Tags and Sections

ML_FF_LMLFF, ML_FF_MB_MB, ML_FF_MCONF

Examples that use this tag