NPACO

From VASP Wiki

NPACO = [integer]
Default: NPACO = 256 

Description: NPACO sets the number of slots in the pair-correlation function written to PCDAT.


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 articles

APACO, NBLOCK, KBLOCK, PCDAT

Examples that use this tag