TURBOMOLE Users Forum

TURBOMOLE Modules => Escf and Egrad => Topic started by: Xiaoyan on September 21, 2016, 10:43:17 AM

Title: calculated oscillator strength larger than 1
Post by: Xiaoyan on September 21, 2016, 10:43:17 AM

I got the oscillator strength by using B3LYP which is larger than 1,  where COSMO was also included.  Did  anyone get also such results?