Category:Van der Waals functionals: Difference between revisions
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== Theory == | == Theory == | ||
*{{TAG|DFT-D2}} method. | |||
*{{TAG|DFT-D3}} method. | |||
*{{TAG|DDsC dispersion correction}}. | *{{TAG|DDsC dispersion correction}}. | ||
*{{TAG|Many-body dispersion energy}}. | *{{TAG|Many-body dispersion energy}}. | ||
*{{TAG|Tkatchenko-Scheffler method}}. | *{{TAG|Tkatchenko-Scheffler method}}. | ||
*{{TAG|Tkatchenko-Scheffler method with iterative Hirshfeld partitioning}}. | *{{TAG|Tkatchenko-Scheffler method with iterative Hirshfeld partitioning}}. | ||
*{{TAG|Self-consistent screening in Tkatchenko-Scheffler method}}. | *{{TAG|Self-consistent screening in Tkatchenko-Scheffler method}}. | ||
*{{TAG|VdW-DF functional of Langreth and Lundqvist et al.}} | *{{TAG|VdW-DF functional of Langreth and Lundqvist et al.}} | ||
Revision as of 14:43, 20 March 2019
Theory
- DFT-D2 method.
- DFT-D3 method.
- DDsC dispersion correction.
- Many-body dispersion energy.
- Tkatchenko-Scheffler method.
- Tkatchenko-Scheffler method with iterative Hirshfeld partitioning.
- Self-consistent screening in Tkatchenko-Scheffler method.
- VdW-DF functional of Langreth and Lundqvist et al.
How to
- Main tag for van der Waals algorithm: IVDW
- DFT-D2 method.
- DFT-D3 method.
- DDsC dispersion correction.
- Many-body dispersion energy.
- Tkatchenko-Scheffler method.
- Tkatchenko-Scheffler method with iterative Hirshfeld partitioning.
- Self-consistent screening in Tkatchenko-Scheffler method.
- VdW-DF functional of Langreth and Lundqvist et al.
Pages in category "Van der Waals functionals"
The following 57 pages are in this category, out of 57 total.
B
C
H
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- LIBMBD ALPHA
- LIBMBD C6AU
- LIBMBD K GRID
- LIBMBD K GRID SHIFT
- LIBMBD MBD A
- LIBMBD MBD BETA
- LIBMBD METHOD
- LIBMBD N OMEGA GRID
- LIBMBD PARALLEL MODE
- LIBMBD R0AU
- LIBMBD TS D
- LIBMBD TS SR
- LIBMBD VDW PARAMS KIND
- LIBMBD XC
- LSCALER0
- LSCSGRAD
- LSPIN VDW
- LTSSURF
- LUSE VDW
- LVDW EWALD
- LVDW ONECELL
- LVDWEXPANSION
- LVDWSCS