VDW_S6

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Revision as of 09:10, 9 February 2024 by Ftran (talk | contribs)

VDW_S6 = [real]
Default: VDW_S6 = depends on the selected van der Waals method and exchange-correlation functional 

Description: VDW_S6 defines the global scaling factor .


VDW_S6 sets the global scaling factor in the DFT-D2, DFT-D3, DFT-ulg, DDsC, and Tkatchenko-Scheffler methods.

Related tags and articles

DFT-D2, DFT-D3, DFT-ulg, DDsC, Tkatchenko-Scheffler method

Examples that use this tag