Firefly and PC GAMESS-related discussion club
Learn how to ask questions correctly

Conical interestion
Abhineet Agarwal
agarwal.abhi93@gmail.com
Hi,
I was searching for a conical intersection between the ground and the first excited state using a three state averaged theory. But I was being given a severe error, the singular angular variable error. Could any one tell me why this error shows up ?
Mon Apr 6 '15 8:56am
This message read 777 times