VDW_RADIUS
VDW_RADIUS = [real]
| Default: VDW_RADIUS | = 50 | if IVDW=1, 2, 3, 4, or 21 |
| = 50.20 | if IVDW=11, 12, or 15 | |
| = 31.75 | if IVDW=13 |
Description: VDW_RADIUS (in Å) sets the two-body interaction cutoff in van der Waals methods.
VDW_RADIUS (in Å) allows to set the two-body interaction cutoff for the DFT-D2, DFT-D3 (DFT-D3 and simple-DFT-D3 implementations), DFT-D4, DFT-ulg, DDsC, and Tkatchenko-Scheffler methods.
| Mind: Available for the DFT-D4 and simple-DFT-D3 packages since VASP.6.6.0. |
Related tags and articles
IVDW, VDW_CNRADIUS, DFT-D2, DFT-D3, simple-DFT-D3, DFT-D4, DFT-ulg, DDsC, Tkatchenko-Scheffler method, Tkatchenko-Scheffler method with iterative Hirshfeld partitioning