ML LHEAT: Difference between revisions
(Created page with "{{TAGDEF|ML_FF_LHEAT_MB|[logical]|.FALSE.}} Description: ---- == Related Tags and Sections == {{sc|ML_FF_LHEAT_MB|Examples|Examples that use this tag}} ---- Category:INC...") |
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{{TAGDEF|ML_FF_LHEAT_MB|[logical]|.FALSE.}} | {{TAGDEF|ML_FF_LHEAT_MB|[logical]|.FALSE.}} | ||
Description: | Description: This flag specifies whether the heat flux is calculated or not in the machine learning force field method. | ||
---- | ---- | ||
The heat flux is written to the file {{TAG|ML_HEAT}}. | |||
== Related Tags and Sections == | == Related Tags and Sections == | ||
{{TAG|ML_FF_MLFF}, {{TAG|ML_FF_LEATOM_MB}} | |||
{{sc|ML_FF_LHEAT_MB|Examples|Examples that use this tag}} | {{sc|ML_FF_LHEAT_MB|Examples|Examples that use this tag}} | ||
---- | ---- | ||
[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]] | [[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category:VASP6]] | ||
Revision as of 16:11, 13 May 2019
ML_FF_LHEAT_MB = [logical]
Default: ML_FF_LHEAT_MB = .FALSE.
Description: This flag specifies whether the heat flux is calculated or not in the machine learning force field method.
The heat flux is written to the file ML_HEAT.
Related Tags and Sections
{{TAG|ML_FF_MLFF}, ML_FF_LEATOM_MB