ML LSPARSDES: Difference between revisions
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For details on the theory of angular descriptor sparsification see [[Machine learning force field: Theory#Sparsification of angular descriptors|here]]. | For details on the theory of angular descriptor sparsification see [[Machine learning force field: Theory#Sparsification of angular descriptors|here]]. | ||
To use the sparsification of angular descriptors set the following tags: | |||
*{{TAG|ML_FF_LSPARSDES_MB}}=..TRUE.. | |||
== Related Tags and Sections == | == Related Tags and Sections == | ||
Revision as of 18:24, 8 June 2021
ML_FF_LSPARSDES_MB = [logical]
Default: ML_FF_LSPARSDES_MB = .FALSE.
Description: This tag specifies whether sparsification of the angular descriptors is done within machine learning force fields.
For details on the theory of angular descriptor sparsification see here.
To use the sparsification of angular descriptors set the following tags:
- ML_FF_LSPARSDES_MB=..TRUE..
Related Tags and Sections
ML_FF_LMLFF, ML_FF_NRANK_SPARSDES_MB, ML_FF_RDES_SPARSDES_MB