ML LCOUPLE: Difference between revisions
No edit summary |
No edit summary |
||
| (2 intermediate revisions by the same user not shown) | |||
| Line 5: | Line 5: | ||
== Related Tags and Sections == | == Related Tags and Sections == | ||
{{TAG|ML_FF_LMLFF | {{TAG|ML_FF_LMLFF}}, {{TAG|ML_FF_NATOM_COUPLED_MB}}, {{TAG|ML_FF_ICOUPLE_MB}}, {{TAG|ML_FF_RCOUPLE_MB}} | ||
{{sc|ML_FF_LCOUPLE_MB|Examples|Examples that use this tag}} | {{sc|ML_FF_LCOUPLE_MB|Examples|Examples that use this tag}} | ||
---- | ---- | ||
[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category: | [[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category: Alpha]] | ||
Revision as of 15:18, 29 February 2020
ML_FF_LCOUPLE_MB = [logical]
Default: ML_FF_LCOUPLE_MB = .FALSE.
Description: This tag specifies whether coupling parameters are used for the calculation of chemical potentials is used or not within the machine learning force field method.
Related Tags and Sections
ML_FF_LMLFF, ML_FF_NATOM_COUPLED_MB, ML_FF_ICOUPLE_MB, ML_FF_RCOUPLE_MB