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Difference between revisions of "ML FF LHEAT MB"

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(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:
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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_LMLFF}}, {{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]]
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[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category: Alpha]]

Latest revision as of 15:18, 29 February 2020

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

ML_FF_LMLFF, ML_FF_LEATOM_MB

Examples that use this tag