VDW C6: Difference between revisions

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{{TAGDEF|VDW_C6|[real (array)]}}
{{TAGDEF|VDW_C6|[real (array)]}}


Description: {{TAG|VDW_C6}} defines the <math>C_6</math> parameters (<math>\mathrm{Jnm}^{6}\mathrm{mol}^{-1}</math>) for each species defined in the {{TAG|POSCAR}} file within the {{TAG|DFT-D2}} and [[Tkatchenko-Scheffler_method|Tkatchenko-Scheffler]] methods.
Description: {{TAG|VDW_C6}} defines the <math>C_6</math> parameters (<math>\mathrm{Jnm}^{6}\mathrm{mol}^{-1}</math>) for each species defined in the {{TAG|POSCAR}} file.
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{{TAG|VDW_C6}} sets the <math>C_6</math> parameters (<math>\mathrm{Jnm}^{6}\mathrm{mol}^{-1}</math>) for each species defined in the {{TAG|POSCAR}} file for the [[DFT-D2]], [[DFT-ulg]], [[Tkatchenko-Scheffler_method|Tkatchenko-Scheffler]], and [[Many-body dispersion energy|Many-body dispersion energy]] methods.


== Related tags and articles ==
== Related tags and articles ==
{{TAG|DFT-D2}}
{{TAG|VDW_C6AU}},
{{TAG|Tkatchenko-Scheffler_method}}
[[DFT-D2]],
[[DFT-ulg]],
[[Tkatchenko-Scheffler_method|Tkatchenko-Scheffler method]],
[[Many-body dispersion energy|Many-body dispersion energy]]


{{sc|VDW_C6|Examples|Examples that use this tag}}
{{sc|VDW_C6|Examples|Examples that use this tag}}

Latest revision as of 09:59, 9 February 2024

VDW_C6 = [real (array)] 

Description: VDW_C6 defines the parameters () for each species defined in the POSCAR file.


VDW_C6 sets the parameters () for each species defined in the POSCAR file for the DFT-D2, DFT-ulg, Tkatchenko-Scheffler, and Many-body dispersion energy methods.

Related tags and articles

VDW_C6AU, DFT-D2, DFT-ulg, Tkatchenko-Scheffler method, Many-body dispersion energy

Examples that use this tag