VDW C6AU: Difference between revisions

Revision as of 14:25, 21 March 2022

VDW_C6AU = [real (array)]

Description: VDW_C6AU defines the $C_6$ parameters ( $\mathrm{Hartree}\\mathrm{bohr}^{6}$ ) for each species defined in the POSCAR file within the DFT-D2 and Tkatchenko-Scheffler methods.

Related Tags and Sections

DFT-D2 Tkatchenko-Scheffler_method

Examples that use this tag

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 {{TAGDEF|VDW_C6AU|[real (array)]}}
-Description: {{TAG|VDW_C6AU}} defines the <math>C_6</math> parameters (<math>\mathrm{Hartree}\. \mathrm{bohr}^{6}</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_C6AU}} defines the <math>C_6</math> parameters (<math>\mathrm{Hartree}\\mathrm{bohr}^{6}</math>) for each species defined in the {{TAG|POSCAR}} file within the {{TAG|DFT-D2}} and [[Tkatchenko-Scheffler_method|Tkatchenko-Scheffler]] methods.
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