dmba
Failed
Antechamber
Task Info
Created Time
2/10/2020 12:06:04 AM
Updated Time
2/10/2020 12:06:13 AM
Progress
Output Files
Information
Output Message
Error: cannot run "/usr/local/amber/bin/espgen -o ANTECHAMBER.ESP -i input.gout" in resp() of charge.c properly, exit
Error Message
Error: No ESP fitting centers and fitting values exist, adding 'iop(6/33=2) iop(6/42=6)' to the key word list