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by lbo
Fri Nov 03, 2006 4:20 am
Forum: VTSTTools
Topic: NEB and Dimer
Replies: 6
Views: 15263

NEB and Dimer

Hi VASP users,

I have two questions.

1. NEB requires two minina for input. Can I use two geomery close to minina instead of the exact optimized geometies?

2. For Dimer method. which directory helds the output of the TS structure, 01 or 02?

Thanks.