APACO

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Revision as of 14:38, 17 March 2017 by Karsai (talk | contribs)

APACO = [integer]
Default: APACO = 256 

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.

Related Tags and Sections

NPACO, NBLOCK, KBLOCK, PCDAT

Examples that use this tag

Contents

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