Firefly and PC GAMESS-related discussion club
Learn how to ask questions correctly
Is it possible to get HOMO-LUMO gap for a set of Temperature changes??
Can we obtain HOMO-LUMO gap data for a set of temperatures in FIREFLY? If I am not wrong I can also say "SIngle Point Energy" calculations for a set of Temperatures?
Fri Feb 22 '13 2:52pm
This message read 785 times