TURBOMOLE Users Forum

TURBOMOLE Modules => Ridft, Rdgrad, Dscf, Grad => Topic started by: sareeya on February 19, 2017, 11:32:06 AM

Title: Energy decomposition analysis (EDA)
Post by: sareeya on February 19, 2017, 11:32:06 AM
How can I perform the Energy decomposition analysis (EDA) with Turbomole??
Title: Re: Energy decomposition analysis (EDA)
Post by: prasanta13 on July 31, 2021, 05:26:27 PM
I have not also performed, But the 6.7.1 section of the manual details the procedure.