ML RCUT1

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Revision as of 20:55, 10 October 2021 by Singraber (talk | contribs)

ML_RCUT1 = [real]
Default: ML_RCUT1 = 5.0 

Description: This flag sets the cutoff radius for the radial descriptor in the machine learning force field method as described in this section.


The unit of the cut-off radius is . The value of ML_RCUT1 is the default value for ML_RCUT2.

Related Tags and Sections

ML_LMLFF, ML_RCUT2, ML_W1, ML_SION1, ML_SION2

Examples that use this tag