ML MCONF NEW: Difference between revisions
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{{TAGDEF|ML_FF_MCONF_NEW|[integer]|5}} | {{TAGDEF|ML_FF_MCONF_NEW|[integer]|5}} | ||
Description: This flag sets the | Description: This flag sets the number of configurations that are stored temporally as candidates for the training data in the machine learning force field method. | ||
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This value is empirically set and should usually not be touched. | This value is empirically set and should usually not be touched. | ||
Revision as of 12:24, 27 May 2019
ML_FF_MCONF_NEW = [integer]
Default: ML_FF_MCONF_NEW = 5
Description: This flag sets the number of configurations that are stored temporally as candidates for the training data in the machine learning force field method.
This value is empirically set and should usually not be touched.