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ML FF IBROAD2 MB

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ML_FF_IBROAD2_MB = [integer]
Default: ML_FF_IBROAD2_MB = 2 

Description: This tag determines how the atomic distribution is broadened for the angular descriptor within the machine learning force field method.


The following cases are possible:

Related Tags and Sections

ML_FF_LMLFF, ML_FF_SION1_MB, ML_FF_SION2_MB, ML_FF_IBROAD1_MB

Examples that use this tag