HITOLER: Difference between revisions

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[[Category:INCAR tags]][[Category:Van der Waals]]
[[Category:INCAR tag]][[Category:Van der Waals]]

Revision as of 14:19, 8 April 2022

HITOLER = [real]
Default: HITOLER =  

Description: HITOLER specifies the convergence parameter for iterative Hirschfeld partitioning (DFT-TS/HI).


Related tags and articles

LVDW, DFT-D2, DFT-D3, Tkatchenko-Scheffler method, Tkatchenko-Scheffler method with iterative Hirshfeld partitioning, Many-body dispersion energy, dDsC dispersion correction


Examples that use this tag