VDW R0: Difference between revisions
No edit summary |
|||
| (5 intermediate revisions by the same user not shown) | |||
| Line 2: | Line 2: | ||
{{TAGDEF|VDW_R0|[real (array)]}} | {{TAGDEF|VDW_R0|[real (array)]}} | ||
Description: {{TAG|VDW_R0}} defines the <math>R_0</math> parameters (<math>\AA</math>) for each species defined in the {{TAG| | Description: {{TAG|VDW_R0}} defines the <math>R_0</math> parameters (<math>\AA</math>) for each species defined in the {{TAG|POSCAR}} file. | ||
---- | ---- | ||
{{TAG|VDW_R0}} sets the <math>R_0</math> parameters (<math>\AA</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_R0AU}}, | ||
[[DFT-D2]], | |||
[[DFT-ulg]], | |||
[[Tkatchenko-Scheffler_method|Tkatchenko-Scheffler method]], | |||
[[Many-body dispersion energy|Many-body dispersion energy]] | |||
{{sc|VDW_R0|Examples|Examples that use this tag}} | {{sc|VDW_R0|Examples|Examples that use this tag}} | ||
---- | ---- | ||
[[Category:INCAR tag]][[Category:Exchange-correlation functionals]][[Category:van der Waals]] | [[Category:INCAR tag]][[Category:Exchange-correlation functionals]][[Category:van der Waals functionals]] | ||
Latest revision as of 09:57, 9 February 2024
VDW_R0 = [real (array)]
Description: VDW_R0 defines the parameters () for each species defined in the POSCAR file.
VDW_R0 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_R0AU, DFT-D2, DFT-ulg, Tkatchenko-Scheffler method, Many-body dispersion energy