Search found 1 match

by captainalright
Fri Jan 17, 2014 12:45 am
Forum: VTSTTools
Topic: xdat2xyz.pl giving me error
Replies: 0
Views: 17383

xdat2xyz.pl giving me error

Hi there,

When I try to run the xdat2xyz.pl script, I get the output...

OPEN XDATCAR ...
VASP 5 format

and the corresponding movie file looks like:

FORCE: ... ENERGY: -359.86939816

FORCE: ... ENERGY: -359.75776610

FORCE: ... ENERGY: -359.63533047

FORCE: ... ENERGY: -359.51360796

FORCE ...