ALDAC: Difference between revisions
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{{TAG|ALDAC}} can be used as the fraction of LDA correlation in a Hartree-Fock/DFT hybrid functional. | {{TAG|ALDAC}} can be used as the fraction of LDA correlation in a Hartree-Fock/DFT hybrid functional. | ||
{{NB|mind| | |||
*{{TAG|ALDAC}} is implemented for all functionals listed at {{TAG|GGA}} except AM05. | |||
*{{TAG|ALDAC}} is implemented for the functionals from Libxc (see {{TAG|LIBXC1}} for details). | |||
}} | |||
== Related tags and articles == | == Related tags and articles == | ||
Latest revision as of 10:22, 7 February 2024
ALDAC = [real]
| Default: ALDAC | = 1.0 | if LHFCALC[math]\displaystyle{ = }[/math].FALSE. or AEXX[math]\displaystyle{ \neq }[/math]1.0 |
| = 0.0 | if LHFCALC[math]\displaystyle{ = }[/math].TRUE. and AEXX[math]\displaystyle{ = }[/math]1.0 |
Description: ALDAC is a parameter that multiplies the LDA correlation functional or the LDA part of the GGA correlation functional.
ALDAC can be used as the fraction of LDA correlation in a Hartree-Fock/DFT hybrid functional.
| Mind: |
Related tags and articles
AEXX, ALDAX, AGGAX, AGGAC, AMGGAX, AMGGAC, LHFCALC, List of hybrid functionals, Hybrid functionals: formalism