ALDAC

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.

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ALDAC can be used as the fraction of LDA correlation in a Hartree-Fock/DFT hybrid functional.

Mind: ALDAC is implemented for all functionals listed at GGA except AM05. ALDAC is implemented for the functionals from Libxc (see LIBXC1 for details).

Related tags and articles

AEXX, ALDAX, AGGAX, AGGAC, AMGGAX, AMGGAC, LHFCALC, List of hybrid functionals, Hybrid functionals: formalism

Examples that use this tag

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