ML RCUT2: Difference between revisions

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{{TAGDEF|ML_FF_RCUT1_MB|[real]|5.0}}
{{TAGDEF|ML_FF_RCUT2_MB|[real]|ML_FF_RCUT1_MB}}





Revision as of 09:52, 16 November 2020

ML_FF_RCUT2_MB = [real]
Default: ML_FF_RCUT2_MB = ML_FF_RCUT1_MB 


Description: This flag sets the cutoff radius for the angular descriptor in the machine learning force field method.


The unit of the cut-off radius is given in .

Related Tags and Sections

ML_FF_LMLFF, ML_FF_RCUT1_MB, ML_FF_W1_MB, ML_FF_W2_MB

Examples that use this tag