LVDW_EWALD

From VASP Wiki
Revision as of 13:27, 4 October 2022 by Tbucko (talk | contribs)

LVDW_EWALD = logical
Default: LVDW_EWALD = .FALSE. 

Description: LVDW_EWALD decides whether lattice summation in expression by means of Ewald's summation is computed in the pairwise van der Waals corrections schemes, including DFT-D2, Tkatchenko-Scheffler method, or Tkatchenko-Scheffler method with iterative Hirshfeld partitioning. Available in VASP.5.3.4 and later.


Related tags and articles

DFT-D2

Examples that use this tag