XC_C

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Revision as of 10:24, 31 January 2024 by Ftran (talk | contribs)

XC_C = [real array]
Default: XC_C = 1.0*NXC 

Description: Multiplication factors for the components of the functional given by the XC tag.


XC_C sets the factors that multiply each component of the functional specified with the XC tag. The number of values specified with XC_C has to be equal to the number of functional components set with XC (NXC). Examples of how to use XC_C are provided at XC.


Mind: The XC_C tag can be used together with the ALDAX, ALDAC, AGGAX, AGGAC, AMGGAX, and AMGGAC tags that can be used when LHFCALC=.TRUE.. Such an example is provided at XC.

Related tags and articles

XC, GGA, METAGGA, ALDAX, ALDAC, AGGAX, AGGAC, AMGGAX, AMGGAC

Examples that use this tag