VDW SR: Difference between revisions
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{{TAGDEF|VDW_SR|[real]|1.0}} | {{TAGDEF|VDW_SR|[real]|1.0}} | ||
Description: {{TAG|VDW_SR}} defines the damping function parameter <math>s_{R}</math> (or scaling factor) in the {{TAG|DFT-D2}} | Description: {{TAG|VDW_SR}} defines the damping function parameter <math>s_{R}</math> (or scaling factor) in the {{TAG|DFT-D2}}, {{TAG|DFT-D3}} or [[Tkatchenko-Scheffler_method|Tkatchenko-Scheffler]] method. | ||
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Revision as of 15:10, 7 February 2024
VDW_SR = [real]
Default: VDW_SR = 1.0
Description: VDW_SR defines the damping function parameter (or scaling factor) in the DFT-D2, DFT-D3 or Tkatchenko-Scheffler method.