ZAB VDW: Difference between revisions

Revision as of 14:48, 8 April 2022

ZAB_VDW = [real]
Default: ZAB_VDW = -0.8491

Description: The tag ZAB_VDW specifies the value of the parameter $Z_{ab}$ in the kernel of the non-local van der Waals correlation functional of Dion et al.^[1]

In a revised version of the vdW correlation functional from Lee et al.^[2], $Z_{ab}=-1.8867$ .

[[Category:van der Waals functionals]

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	[[Category:INCAR tag]][[Category:Exchange-correlation functionals]][[Category:van der Waals]]		[[Category:INCAR tag]][[Category:Exchange-correlation functionals]][[Category:van der Waals functionals]