VDW CNRADIUS: Difference between revisions
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{{TAGDEF|VDW_CNRADIUS|[real]}} | {{TAGDEF|VDW_CNRADIUS|[real]|1600}} | ||
Description: {{TAG|VDW_CNRADIUS}} defines the cutoff radius (in <math>\AA</math>) for the calculation of the coordination numbers used in the {{TAG|DFT-D3}} method. | Description: {{TAG|VDW_CNRADIUS}} defines the cutoff radius (in <math>\AA</math>) for the calculation of the coordination numbers used in the {{TAG|DFT-D3}} method. | ||
Revision as of 13:38, 7 February 2018
VDW_CNRADIUS = [real]
Default: VDW_CNRADIUS = 1600
Description: VDW_CNRADIUS defines the cutoff radius (in ) for the calculation of the coordination numbers used in the DFT-D3 method.
