VDW C6AU: Difference between revisions
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{{TAGDEF|VDW_C6AU|[real (array)]}} | {{TAGDEF|VDW_C6AU|[real (array)]}} | ||
Description: {{TAG|VDW_C6AU}} defines the <math>C_6</math> parameters (<math>\mathrm{Hartree}</math> <math>\mathrm{bohr}^{6}</math>) for each species defined in the {{TAG|POSCAR}} file within the | Description: {{TAG|VDW_C6AU}} defines the <math>C_6</math> parameters (<math>\mathrm{Hartree}</math> <math>\mathrm{bohr}^{6}</math>) for each species defined in the {{TAG|POSCAR}} file within the [[Tkatchenko-Scheffler_method|Tkatchenko-Scheffler]] method. | ||
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== Related Tags and Sections == | == Related Tags and Sections == | ||
{{TAG|Tkatchenko-Scheffler_method}} | {{TAG|Tkatchenko-Scheffler_method}} | ||
Revision as of 14:41, 21 March 2022
VDW_C6AU = [real (array)]
Description: VDW_C6AU defines the [math]\displaystyle{ C_6 }[/math] parameters ([math]\displaystyle{ \mathrm{Hartree} }[/math] [math]\displaystyle{ \mathrm{bohr}^{6} }[/math]) for each species defined in the POSCAR file within the Tkatchenko-Scheffler method.