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Last update: 12 April 2004

Hrant Hratchian

Email: hrant@chem.wayne.edu
Webpage:

Post-doc, Indiana University, with Krishnan Raghavachari
Ph.D., Physical Chemistry (Quantum), Wayne State University, 2005
B. Sc., Eastern Michigan University, Ypsilanti, MI, 2001

Contributions to Gaussian:
Reaction Path Following

H. P. Hratchian and H. B. Schlegel, "Following Reaction Pathways Using a Damped Classical Trajectory Algorithm", J. Phys. Chem. A., 106 (2002), 165-169.

H. P. Hratchian, T. Prendergast, M. C. Milletti, "Theoretical Investigation of Substituent Effects on the Silicon-Metal Bond for a Series of Transition Metal-Substituted Base-Stabilized Silylene Complexes", Polyhedron, 20 (2001), 209-213.

H. P. Hratchian and H. B. Schlegel, "Reaction Path Following Using a Hessian Based Predictor – Corrector Algorithm", J. Chem. Phys.(in press).