VDW_C6AU

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.

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VDW_C6AU sets the $C_6$ parameters ($\mathrm{Hartree}$ $\mathrm{bohr}^{6}$) for each species defined in the POSCAR file in the Tkatchenko-Scheffler and Many-body dispersion energy methods.

Related tags and articles

VDW_C6, Tkatchenko-Scheffler method, Many-body dispersion energy

Examples that use this tag

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