TURBOMOLE Users Forum

TURBOMOLE Modules => Treatment of Solvation Effects with COSMO => Topic started by: basklau on March 10, 2010, 02:17:55 PM

Title: COSMO model in excited states
Post by: basklau on March 10, 2010, 02:17:55 PM

Is it planned to implement COSMO for first and second derivatives in excited state (TDDFT) calculations in the near future, in order to calculation structures and vibrational frequencies?

basklau