VDW_RADIUS

VDW_RADIUS = [real]
Default: VDW_RADIUS = 50 

Description: Defines the cutoff radius (in $\mathrm {\AA}$) for the van der Waals pair interactions.

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VDW_RADIUS sets the cutoff radius for the van der Waals pair interactions in $\mathrm {\AA}$ for 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

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