LSPIN VDW: Difference between revisions
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{{NB|mind|{{TAG|LSPIN_VDW}}=.TRUE. is possible only for van der Waals functionals that consist of a {{TAG|GGA}} for the semilocal part and the kernel type of Dion ''et al.''{{cite|dion:prl:2004}} ({{TAG|IVDW_NL}}=1) for the nonlocal part.}} | {{NB|mind|{{TAG|LSPIN_VDW}}=.TRUE. is possible only for van der Waals functionals that consist of a {{TAG|GGA}} for the semilocal part and the kernel type of Dion ''et al.''{{cite|dion:prl:2004}} ({{TAG|IVDW_NL}}=1) for the nonlocal part.}} | ||
{{NB|mind|This method requires the use of {{TAG|POTCAR}} files from the PAW dataset version 52 or later.}} | |||
== Related tags and articles == | == Related tags and articles == | ||
Revision as of 16:48, 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).
| Mind: {{{2}}} |
| Mind: This method requires the use of POTCAR files from the PAW dataset version 52 or later. |
Related tags and articles
LUSE_VDW, IVDW_NL, Nonlocal vdW-DF functionals