ML SION2: Difference between revisions

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== Related Tags and Sections ==
== Related Tags and Sections ==
{{TAG|ML_FF_LMLFF}}, {{TAG|ML_FF_SION1_MB}}, {{TAG|ML_FF_IBROAD1_MB}}, {{TAG|ML_FF_IBROAD2_MB}}
{{TAG|ML_FF_LMLFF}}, {{TAG|ML_FF_SION1_MB}}, {{TAG|ML_FF_IBROAD1_MB}}, {{TAG|ML_FF_IBROAD2_MB}}


{{sc|ML_FF_SION2_MB|Examples|Examples that use this tag}}
{{sc|ML_FF_SION2_MB|Examples|Examples that use this tag}}

Revision as of 07:28, 21 May 2019

ML_FF_SION2_MB = [real] 

Default: ML_FF_SION2_MB = none if ML_FF_IBROAD2_MB=1
= none 0.5

Description: This tag specifies the width of the Gaussian functions used for broadening the atomic distributions of the angular descriptor within the machine learning force field method.


This tag is only set if ML_FF_IBROAD2_MB is not equal 1.

Related Tags and Sections

ML_FF_LMLFF, ML_FF_SION1_MB, ML_FF_IBROAD1_MB, ML_FF_IBROAD2_MB

Examples that use this tag