Dear Friends,
I am trying to optimize the structure of a 5-layer slab metal surface
using CG. There are 20 atoms in the structure, 8 of which are
constrained. I submitted the job into our server. After 2 CG steps, it
seems that the job "stops". However, there is no error report and I
checked the status of the job which shows it is still running. It is
really strange that the past whole day there is no calculation progress.
Anyone knows what might be the problem? Thank you very much.
Yours,
---Zhen Zhu