LSPIN VDW: Difference between revisions

Revision as of 16:44, 14 February 2023

LSPIN_VDW = [logical]
Default: LSPIN_VDW = .FALSE.

Description: LSPIN_VDW=.TRUE. switches on the use of the spin-polarized formulation for the nonlocal part of a van der Waals functional (available as of VASP.6.4.0).

LSPIN_VDW=.TRUE. is available only for van der Waals functionals that consist of a GGA and the kernel type of Dion et al.^[1] (IVDW_NL=1).

Related tags and articles

LUSE_VDW, IVDW_NL, Nonlocal vdW-DF functionals

↑ M. Dion, H. Rydberg, E. Schröder, D. C. Langreth, and B. I. Lundqvist, Phys. Rev. Lett. 92, 246401 (2004).

[dion:prl:2004-1] M. Dion, H. Rydberg, E. Schröder, D. C. Langreth, and B. I. Lundqvist, Phys. Rev. Lett. 92, 246401 (2004).

[1]

@@ Line 2: / Line 2: @@
 {{TAGDEF|LSPIN_VDW|[logical]|.FALSE.}}
-Description: {{TAG|LSPIN_VDW}}=.TRUE. switches on the use of the spin-polarized formulation{{cite|Thonhauser:prl:2015}} of the nonlocal part of a van der Waals functional (available as of VASP.6.4.0).
+Description: {{TAG|LSPIN_VDW}}=.TRUE. switches on the use of the spin-polarized formulation{{cite|Thonhauser:prl:2015}} for the nonlocal part of a van der Waals functional (available as of VASP.6.4.0).
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