How To get MODECAR?

Bader charge density analysis

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edenantish
Posts: 3
Joined: Fri May 03, 2013 8:28 pm

How To get MODECAR?

Post by edenantish »

I'm a new user of this site. Pls how coluld I generate MODECAR from a given POSCAR.
I used modemake.pl but it needs two files, POSCAR1 and POSCAR2. How could I generate these two poscar files?

THANKS
ANTENEH
wilson
Posts: 1
Joined: Wed Sep 25, 2013 5:51 am

Re: How To get MODECAR?

Post by wilson »

when I finished a CNEB calculations effectively, then I used the nebresult.pl applications, there was no problem. But the next stage, when I use the neb2dim.pl to generate the details for a new dimer calculations, the MODECAR is empty, why?
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