HITOLER: Difference between revisions

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{{TAGDEF|HITOLER|[real]|<math>5\times10^{-5}</math>}}
{{TAGDEF|HITOLER|[real]|<math>5\times10^{-5}</math>}}


Description: {{TAG|HITOLER}} specifies the convergence parameter for iterative Hirschfeld partitioning (DFT-TS/HI).
Description: {{TAG|HITOLER}} specifies the convergence parameter for the iterative Hirschfeld partitioning in the Tkatchenko-Scheffler method.
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== Related tags and articles ==
== Related tags and articles ==
{{TAG|LVDW}},
{{TAG|IVDW}},
{{TAG|DFT-D2}},
{{TAG|DFT-D2}},
{{TAG|DFT-D3}},
{{TAG|DFT-D3}},
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{{TAG|Many-body dispersion energy}},
{{TAG|Many-body dispersion energy}},
{{TAG|dDsC dispersion correction}}
{{TAG|dDsC dispersion correction}}


{{sc|HITOLER|Examples|Examples that use this tag}}
{{sc|HITOLER|Examples|Examples that use this tag}}
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[[Category:INCAR tag]][[Category:van der Waals functionals]]
[[Category:INCAR tag]][[Category:Exchange-correlation functionals]][[Category: van der Waals functionals]]

Latest revision as of 14:51, 18 October 2023

HITOLER = [real]
Default: HITOLER =  

Description: HITOLER specifies the convergence parameter for the iterative Hirschfeld partitioning in the Tkatchenko-Scheffler method.


Related tags and articles

IVDW, DFT-D2, DFT-D3, Tkatchenko-Scheffler method, Tkatchenko-Scheffler method with iterative Hirshfeld partitioning, Many-body dispersion energy, dDsC dispersion correction

Examples that use this tag