Hi,
Now, I can run the vasp with VTSTcode nomally. the problem is my POSCAR, I give a wrong formate POSCAR file, so it always give those error information. The problem did come out when I compile vasp with the VTSTCODE, but the problem is result from my inattention.
Thank you for your attention!
Search found 2 matches
- Tue Jun 30, 2009 7:43 am
- Forum: VTSTTools
- Topic: run error when use NEB calculating transition state
- Replies: 2
- Views: 9956
- Sun Jun 28, 2009 3:08 am
- Forum: VTSTTools
- Topic: run error when use NEB calculating transition state
- Replies: 2
- Views: 9956
run error when use NEB calculating transition state
Hi,
I am a newer to study transition state by vasp. These two days I finished installing NEB to my vasp. But whenever I run transition state calculation, it can not work at all. the informaiton provided about the error is :
[lfj@TCCL008-01 tst]$ forrtl: severe (174): SIGSEGV, segmentation fault ...
I am a newer to study transition state by vasp. These two days I finished installing NEB to my vasp. But whenever I run transition state calculation, it can not work at all. the informaiton provided about the error is :
[lfj@TCCL008-01 tst]$ forrtl: severe (174): SIGSEGV, segmentation fault ...