LSCSGRAD: Difference between revisions

Revision as of 14:36, 6 April 2022

LSCSGRAD = .TRUE. | .FALSE.
Default: LSCSGRAD = .TRUE.

Description: LSCSGRAD decides whether to compute gradients in the calculation of the MBD dispersion energy.

Revision as of 10:19, 19 April 2019 (view source) Karsai (talk \| contribs) No edit summary ← Older edit		Revision as of 14:36, 6 April 2022 (view source) Ftran (talk \| contribs) No edit summary Newer edit →
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	{{TAGDEF\|LSCSGRAD\|.TRUE. {{!}} .FALSE.\|.~~FALSE~~.}}		{{TAGDEF\|LSCSGRAD\|.TRUE. {{!}} .FALSE.\|.TRUE.}}

	Description: {{TAGDEF\|LSCSGRAD}} decides whether to compute gradients in the calculation of the MBD dispersion energy.		Description: {{TAGDEF\|LSCSGRAD}} decides whether to compute gradients in the calculation of the MBD dispersion energy.