Hi
I am facing the problem of running dmol3 on a crystal structure with solvation mode and cosmo checked but getting the job failure notice. Error message which I am getting is as follows-
cosmo IBS grid
Message: DMol3 job failed
Error: DMol3 exiting
Error: no cosmo surface found
Error: no cosmo surface found
I am using MS-7.0. What can be the reason for this?
Regards
Janhvi