TURBOMOLE Users Forum

TURBOMOLE Modules => Ricc2 => Topic started by: wuhen on September 05, 2010, 02:41:22 PM

Title: how to perform excitation energy calculation using RICC2
Post by: wuhen on September 05, 2010, 02:41:22 PM

hi
I have done  geometric optimation for a molecular system, now, how i can get the excitation energy? Is somewhat should be added to control file?
regards

Title: Re: how to perform excitation energy calculation using RICC2
Post by: christof.haettig on November 18, 2010, 05:46:30 PM

Well,  usually it a good idea to read first the manual before one starts a caluculation....
The TURBOMOLE manual will help you.

Christof