VDW ALPHA: Difference between revisions

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Description: {{TAG|VDW_ALPHA}} defines the polarizability <math>\alpha_{0}</math> (bohr<math>^{3}</math>) for each species defined in the {{TAG|POSCAR}} file.
Description: {{TAG|VDW_ALPHA}} defines the polarizability <math>\alpha_{0}</math> (bohr<math>^{3}</math>) for each species defined in the {{TAG|POSCAR}} file.
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{{TAG|VDW_ALPHA}} sets the polarizability <math>\alpha_{0}</math> (bohr<math>^{3}</math>) for each species defined for the {{TAG|POSCAR}} file in the [[Tkatchenko-Scheffler_method|Tkatchenko-Scheffler]] and [[Many-body dispersion energy|Many-body dispersion energy]] methods.
{{TAG|VDW_ALPHA}} sets the polarizability <math>\alpha_{0}</math> (bohr<math>^{3}</math>) for each species defined for the {{TAG|POSCAR}} file for the [[Tkatchenko-Scheffler_method|Tkatchenko-Scheffler]] and [[Many-body dispersion energy|Many-body dispersion energy]] methods.


== Related tags and articles ==
== Related tags and articles ==

Revision as of 09:58, 9 February 2024

VDW_ALPHA = [real (array)] 

Description: VDW_ALPHA defines the polarizability (bohr) for each species defined in the POSCAR file.


VDW_ALPHA sets the polarizability (bohr) for each species defined for the POSCAR file for the Tkatchenko-Scheffler and Many-body dispersion energy methods.

Related tags and articles

Tkatchenko-Scheffler method, Many-body dispersion energy

Examples that use this tag