Ab initio transition state theory for polar reactions in solution

A Combined Theoretical and Experimental Study on the Role of Spin States in the Chemistry of Fe(CO)5Photoproducts

(2009) Maria Besora et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Dynamics and the Failure of Transition State Theory in Alkene Hydroboration

(2009) Yatsandra Oyola et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

A Universal Approach to Solvation Modeling

(2008) Christopher J. Cramer et al.   ACCOUNTS OF CHEMICAL RESEARCH

Localized orbital corrections applied to thermochemical errors in density functional theory: The role of basis set and application to molecular reactions

(2008) Dahlia A. Goldfeld et al.   JOURNAL OF CHEMICAL PHYSICS

Eliminating the domain error in local explicitly correlated second-order Møller–Plesset perturbation theory

(2008) Hans-Joachim Werner   JOURNAL OF CHEMICAL PHYSICS

The accuracy of local MP2 methods for conformational energies

(2008) Jakub Kaminsky et al.   MOLECULAR PHYSICS