ML LMAX2: Difference between revisions
(Created page with "{{TAGDEF|ML_FF_LMAX2_MB|[integer]|6}} Description: ---- == Related Tags and Sections == {{sc|ML_FF_LMAX2_MB|Examples|Examples that use this tag}} ---- Category:INCAR...") |
No edit summary |
||
| Line 1: | Line 1: | ||
{{TAGDEF|ML_FF_LMAX2_MB|[integer]|6}} | {{TAGDEF|ML_FF_LMAX2_MB|[integer]|6}} | ||
Description: | Description: This tag specifies the maximum angular momentum quantum number of spherical harmonics used to expand atomic distributions within the machine learning force field method. | ||
---- | ---- | ||
== Related Tags and Sections == | == Related Tags and Sections == | ||
{{TAG|ML_FF_LMLFF}}, {{TAG|ML_FF_MSPL1_MB}}, {{TAG|ML_FF_MSPL2_MB}}, {{TAG|ML_FF_NR1_MB}}, {{TAG|ML_FF_NR2_MB}}, {{TAG|ML_FF_MRB1_MB}}, {{TAG|ML_FF_MRB2_MB}} | |||
{{sc|ML_FF_LMAX2_MB|Examples|Examples that use this tag}} | {{sc|ML_FF_LMAX2_MB|Examples|Examples that use this tag}} | ||
---- | ---- | ||
[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]] | [[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category:VASP6]] | ||
Revision as of 07:51, 21 May 2019
ML_FF_LMAX2_MB = [integer]
Default: ML_FF_LMAX2_MB = 6
Description: This tag specifies the maximum angular momentum quantum number of spherical harmonics used to expand atomic distributions within the machine learning force field method.
Related Tags and Sections
ML_FF_LMLFF, ML_FF_MSPL1_MB, ML_FF_MSPL2_MB, ML_FF_NR1_MB, ML_FF_NR2_MB, ML_FF_MRB1_MB, ML_FF_MRB2_MB