VDW S8: Difference between revisions
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== Related tags and articles == | == Related tags and articles == | ||
[[DFT-D3]],[[DFT-D4]] | [[DFT-D3]],[[DFT-D4]]{{DISPLAYTITLE:VDW_S8}} | ||
{{TAGDEF|VDW_S8|[real]}} | |||
Description: {{TAG|VDW_S8}} sets the scaling <math>s_{8}</math> of the dipole-quadrupole dispersion of the DFT-D3 and [[DFT-D4]] methods. | |||
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{{TAG|VDW_S8}} allows to set the scaling <math>s_{8}</math> of the dipole-quadrupole dispersion of the DFT-D3 and [[DFT-D4]] ({{TAG|IVDW}}=13) methods. {{TAG|VDW_S8}} can be used for both implementations of DFT-D3: [[DFT-D3]] ({{TAG|IVDW}}=11 or 12) and [[simple-DFT-D3]] ({{TAG|IVDW}}=15). | |||
== Related tags and articles == | |||
{{TAG|IVDW}}, | |||
{{TAG|VDW_S6}}, | |||
[[DFT-D3]], | |||
[[simple-DFT-D3]], | |||
[[DFT-D4]] | |||
{{sc|VDW_S8|Examples|Examples that use this tag}} | |||
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[[Category:INCAR tag]][[Category:Exchange-correlation functionals]][[Category:van der Waals functionals]] | |||
{{sc|VDW_S8|Examples|Examples that use this tag}} | {{sc|VDW_S8|Examples|Examples that use this tag}} | ||
Revision as of 11:05, 2 March 2026
VDW_S8 = [real]
| Default: VDW_S8 | = 1.0 | for DFT-D3 |
Description: VDW_S8 defines the damping function parameter [math]\displaystyle{ s_{8} }[/math].
VDW_S8 sets the damping function parameter [math]\displaystyle{ s_{8} }[/math] in the DFT-D3 and DFT-D4 methods.
Related tags and articles
Description: VDW_S8 sets the scaling [math]\displaystyle{ s_{8} }[/math] of the dipole-quadrupole dispersion of the DFT-D3 and DFT-D4 methods.
VDW_S8 allows to set the scaling [math]\displaystyle{ s_{8} }[/math] of the dipole-quadrupole dispersion of the DFT-D3 and DFT-D4 (IVDW=13) methods. VDW_S8 can be used for both implementations of DFT-D3: DFT-D3 (IVDW=11 or 12) and simple-DFT-D3 (IVDW=15).
Related tags and articles
IVDW, VDW_S6, DFT-D3, simple-DFT-D3, DFT-D4