1 |
Theoretical-Study of Bifurcating Reaction Paths Yanai T, Taketsugu T, Hirao K Journal of Chemical Physics, 107(4), 1137, 1997 |
2 |
Gradient Line Reaction Paths for Hindered Internal-Rotation in H2Bnh2 and Inversion in Pf3 Minyaev RM, Wales DJ, Walsh TR Journal of Physical Chemistry A, 101(7), 1384, 1997 |
3 |
Reaction-Path Hamiltonian Based on a Reaction Coordinate and a Curvature Coordinate Taketsugu T, Gordon MS Journal of Chemical Physics, 104(8), 2834, 1996 |
4 |
Reaction-Path Dynamics in Curvilinear Internal Coordinates Including Torsions Nguyen KA, Jackels CF, Truhlar DG Journal of Chemical Physics, 104(17), 6491, 1996 |
5 |
Approaches to Bifurcating Reaction-Path Taketsugu T, Tajima N, Hirao K Journal of Chemical Physics, 105(5), 1933, 1996 |
6 |
Reaction-Path Potential and Vibrational Frequencies in Terms of Curvilinear Internal Coordinates Jackels CF, Gu Z, Truhlar DG Journal of Chemical Physics, 102(8), 3188, 1995 |
7 |
Locating Transition Structures by Mode Following - A Comparison of 6 Methods on the Ar-8 Lennard-Jones Potential Jensen F Journal of Chemical Physics, 102(17), 6706, 1995 |
8 |
Gradient Fields of Potential-Energy Surfaces Ruedenberg K, Sun JQ Journal of Chemical Physics, 100(8), 5836, 1994 |
9 |
Rearrangements of 55-Atom Lennard-Jones and (C-60)(55) Clusters Wales DJ Journal of Chemical Physics, 101(5), 3750, 1994 |
10 |
Clusters - Tools for Studying Potential Surfaces and Their Connection to Molecular-Dynamics Berry RS Journal of Physical Chemistry, 98(28), 6910, 1994 |