ML RCUT2: Difference between revisions

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 $\mathrm {\AA}$ .

Revision as of 15:21, 29 February 2020 (view source) Karsai (talk \| contribs) No edit summary ← Older edit		Revision as of 09:52, 16 November 2020 (view source) Karsai (talk \| contribs) No edit summary Newer edit →
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	{{TAGDEF\|~~ML_FF_RCUT1_MB~~\|[real]\|~~5.0~~}}		{{TAGDEF\|ML_FF_RCUT2_MB\|[real]\|ML_FF_RCUT1_MB}}