APACO: Difference between revisions

Revision as of 13:51, 7 April 2022

APACO = [real]
Default: APACO = 16

Description: APACO sets the maximum distance in the evaluation of the pair-correlation function (in Å).

VASP evaluates the pair-correlation function each NBLOCK steps and writes the PC-function after NBLOCK×KBLOCK steps to the PCDAT file.

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	[[The_VASP_Manual\|Contents]]		[[The_VASP_Manual\|Contents]]

	[[Category:INCAR]][[Category:Molecular ~~Dynamics~~]]		[[Category:INCAR]][[Category:Molecular dynamics]]