The following are publications made possible by iCER resources. MSU faculty that would like to highlight the output of their research that's benefited from iCER resources are invited to contact us.
Export 548 results:Author Title Type [ Year]
Filters: Author is Truhlar, D.G. [Clear All Filters]
“Thermochemical Kinetics for Multi-reference Systems: Addition Reactions of Ozone”, Journal of Physical Chemistry A, vol. 113, no. 19, pp. 5786-5799, 2009.,
“Application of Renormalized Coupled- Cluster Methods to Potential Function of Water”, Theoretical Chemistry Accounts: Theory, Computation, and Modeling (THEORETICA CHIMICA ACTA), vol. 120, no. 1-3, pp. 59-78, 2008.,
“A Comparative Assessment of the Perturbative and Renormalized Coupled Cluster Theories with a Non-iterative Treatment of Triple Excitations for Thermochemical Kinetics, Including a Study of Basis Set and Core Correlation E”, The Journal of Chemical Physics, vol. 128, no. 4, 2008.,
“Can a Single-Reference Approach Provide a Balanced Description of Ground and Excited States? A Comparison of the Completely Renormalized Equation-of-the-Motion Coupled-Cluster Method with Multi-Reference Quasi-Degenerate Perturbation Theory Near a Conical”, Journal of Chemical Physics A, vol. 109, no. 51, pp. 11643-11646, 2005.,