Requests for technical support from the VASP group should be posted in the VASP-forum.

ML FF RCUT2 MB

From Vaspwiki
Revision as of 10:07, 16 November 2020 by Karsai (talk | contribs)
(diff) ← Older revision | Latest revision (diff) | Newer revision → (diff)
Jump to navigationJump to search
The printable version is no longer supported and may have rendering errors. Please update your browser bookmarks and please use the default browser print function instead.

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_SION1_MB, ML_FF_SION2_MB


Examples that use this tag