ZAB VDW: Difference between revisions
No edit summary |
No edit summary |
||
| (5 intermediate revisions by one other user not shown) | |||
| Line 2: | Line 2: | ||
{{TAGDEF|ZAB_VDW|[real]|-0.8491}} | {{TAGDEF|ZAB_VDW|[real]|-0.8491}} | ||
Description: The tag {{TAG|ZAB_VDW}} specifies the value of the parameter <math>Z_{ab}</math> in the kernel of the [[Nonlocal | Description: The tag {{TAG|ZAB_VDW}} specifies the value of the parameter <math>Z_{ab}</math> in the kernel of the [[Nonlocal vdW-DF functionals|nonlocal vdW-DF functional of Dion ''et al''.]]{{cite|dion:prl:2004}} | ||
---- | ---- | ||
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>. | ||
== Related tags and articles == | == Related tags and articles == | ||
{{TAG| | {{TAG|Nonlocal vdW-DF functionals}}, {{TAG|PARAM1}}, {{TAG|PARAM2}} | ||
== References == | |||
[[Category:INCAR tag]][[Category:van der Waals functionals]] | [[Category:INCAR tag]][[Category:Exchange-correlation functionals]][[Category: van der Waals functionals]] | ||
Latest revision as of 07:19, 8 May 2024
ZAB_VDW = [real]
Default: ZAB_VDW = -0.8491
Description: The tag ZAB_VDW specifies the value of the parameter in the kernel of the nonlocal vdW-DF functional of Dion et al.[1]
In a revised version of the vdW correlation functional from Lee et al.[2], .
Related tags and articles
Nonlocal vdW-DF functionals, PARAM1, PARAM2