VDW RADIUS: Difference between revisions
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{{DISPLAYTITLE:VDW_RADIUS}} | {{DISPLAYTITLE:VDW_RADIUS}} | ||
{{TAGDEF|VDW_RADIUS|[real] | {{TAGDEF|VDW_RADIUS|[real]|50}} | ||
Description: Defines the cutoff radius (in <math>\AA</math>) for the van der Waals pair interactions. | Description: Defines the cutoff radius (in <math>\AA</math>) for the van der Waals pair interactions. | ||
Revision as of 08:50, 9 February 2024
VDW_RADIUS = [real]
Default: VDW_RADIUS = 50
Description: Defines the cutoff radius (in [math]\displaystyle{ \AA }[/math]) for the van der Waals pair interactions.
VDW_RADIUS sets the cutoff radius for the van der Waals pair interactions in [math]\displaystyle{ \AA }[/math] 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