ZAB VDW: Difference between revisions

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{{TAGDEF|ZAB_VDW|[real]|-0.8491}}
{{TAGDEF|ZAB_VDW|[real]|-0.8491}}


Description: The flag {{TAG|ZAB_VDW}} allows to specify the value of the parameter <math>Z_{ab}</math> in the kernel of the non-local vdW correlation functional of Dion ''et al''.{{cite|dion:prl:2004}}
Description: The tag {{TAG|ZAB_VDW}} allows to specify the value of the parameter <math>Z_{ab}</math> in the kernel of the non-local vdW correlation functional of Dion ''et al''.{{cite|dion:prl:2004}}
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In a revised version of the vdW correlation functional from Lee ''et al''.{{cite|lee:prb:2010}}, <math>Z_{ab}=-1.8867</math>.
In a revised version of the vdW correlation functional from Lee ''et al''.{{cite|lee:prb:2010}}, <math>Z_{ab}=-1.8867</math>.

Revision as of 06:51, 8 April 2022

ZAB_VDW = [real]
Default: ZAB_VDW = -0.8491 

Description: The tag ZAB_VDW allows to specify the value of the parameter in the kernel of the non-local vdW correlation functional of Dion et al.[1]


In a revised version of the vdW correlation functional from Lee et al.[2], .

Related tags and articles

VdW-DF functional of Langreth and Lundqvist et al.,PARAM1,PARAM2

Examples that use this tag