Hi,
I have a very simple question. Does it make a difference, for a NEB calculation, if the energy of the initial state is lower than that of the final state ?
I would think it doesn't, but I want to make sure.
Cheers,
MCV
Search found 1 match
- Thu Nov 13, 2014 9:29 am
- Forum: VTSTTools
- Topic: order of images in NEB calculations
- Replies: 1
- Views: 6689