PCDAT

From VASP Wiki
Revision as of 10:05, 23 January 2017 by Karsai (talk | contribs) (Created page with "The {{TAG|PCDAT}} file contains the pair correlation function. For dynamic simulations ({{TAG|IBRION}}<math>ge</math>0) an averaged pair correlation is written to the file (se...")
(diff) ← Older revision | Latest revision (diff) | Newer revision → (diff)

The PCDAT file contains the pair correlation function. For dynamic simulations (IBRION0) an averaged pair correlation is written to the file (see also NBLOCK, KBLOCK, NPACO and APACO).

Contents

Retrieved from "https://www.vasp.at/wiki/index.php?title=PCDAT&oldid=2893"