ZAB VDW: Difference between revisions

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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 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}}
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In a revised version of the vdW correlation functional from Lee 'et al''.{{cite|lee:prb:2010}}, <math>Z_{ab}= −1.887</math>.
In a revised version of the vdW correlation functional from Lee ''et al''.{{cite|lee:prb:2010}}, <math>Z_{ab}= −1.887</math>.


== Related Tags and Sections ==
== Related Tags and Sections ==

Revision as of 19:28, 19 January 2022

Zab_vdW = [real]
Default: Zab_vdW = -0.8491 

Description: The flag 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 Sections

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

Examples that use this tag