graeme wrote:
> If you can attach a .tar.gz file of your calculation, I can help to debug
> the problem.
Sorry I forgot attaching the file,thanks for attention!
Search found 2 matches
- Thu Jul 15, 2021 5:25 am
- Forum: VTSTTools
- Topic: The influence of images used for CINEB
- Replies: 2
- Views: 7967
- Mon Jul 12, 2021 3:58 am
- Forum: VTSTTools
- Topic: The influence of images used for CINEB
- Replies: 2
- Views: 7967
The influence of images used for CINEB
Dear all, I'm trying to use CINEB to search the transition state.Here is my problem: 1、Now I have used 4 images to run CINEB for a round,and I think image 03 is close to the transition state I'm looking for. However ,it costs me a lot of time ,so I want to know if I only use image 03 to run (1 image...