LSCSGRAD: Difference between revisions

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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.

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.


Related Tags and Sections

IVDW, Many-body dispersion energy, LVDWEXPANSION

Examples that use this tag