PLUGINS/ML MODE

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Revision as of 10:00, 16 March 2026 by Schlipf (talk | contribs) (Created page with "{{TAGDEF|PLUGINS/ML_MODE| none {{!}} run | none}} Description: String-based tag selecting operation mode for running {{TAG|PLUGINS/FORCE_AND_STRESS}} plugins. ---- * {{TAG|PLUGINS/ML_MODE|none}} Forces and stress provided by the plugin are added to the ab-initio forces computed by VASP. * {{TAG|PLUGINS/ML_MODE|run}} VASP skips the ab-initio calculation and uses the forces and stress of the plugin to replace the forces of VASP. == Related tags and articles == Plugins...")
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PLUGINS/ML_MODE = none | run
Default: PLUGINS/ML_MODE = none 

Description: String-based tag selecting operation mode for running PLUGINS/FORCE_AND_STRESS plugins.

  • PLUGINS/ML_MODE = none Forces and stress provided by the plugin are added to the ab-initio forces computed by VASP.
  • PLUGINS/ML_MODE = run VASP skips the ab-initio calculation and uses the forces and stress of the plugin to replace the forces of VASP.

Related tags and articles

Plugins, PLUGINS/FORCE_AND_STRESS, PLUGINS/ML_OUTBLOCK, PLUGINS/ML_OUTPUT_MODE, PLUGINS/NEIGHBOR_CUTOFF

Examples that use this tag

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