xdat2xyz.pl giving me error

Vasp transition state theory tools

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captainalright
Posts: 1
Joined: Fri Jan 17, 2014 12:43 am

xdat2xyz.pl giving me error

Post by captainalright »

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: ... ENERGY: -359.40552385

FORCE: ... ENERGY: -359.32408937

FORCE: ... ENERGY: -359.27819020

FORCE: ... ENERGY: -359.27177889


etc.

Is the script somehow not working for 5.2? I downloaded the most reason version posted.

Kurt
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