51 |
Interpolated variational transition-state theory by mapping Corchado JC, Coitino EL, Chuang YY, Fast PL, Truhlar DG Journal of Physical Chemistry A, 102(14), 2424, 1998 |
52 |
Kinematic mass model of activated bimolecular reactions : Reactions of vibrationally excited reactants Perdih M, Smith IWM, Miklavc A Journal of Physical Chemistry A, 102(22), 3907, 1998 |
53 |
Direct dynamics calculations of deuterium and carbon-13 kinetic isotope effects for the reaction Cl+CH4 Roberto-Neto O, Coitino EL, Truhlar DG Journal of Physical Chemistry A, 102(24), 4568, 1998 |
54 |
Dual-level direct dynamics calculations of the reaction rates for a Jahn-Teller reaction : Hydrogen abstraction from CH4 or CD4 by O(P-3) Corchado JC, Espinosa-Garcia J, Roberto-Neto O, Chuang YY, Truhlar DG Journal of Physical Chemistry A, 102(25), 4899, 1998 |
55 |
Self-consistent reaction field calculations of nonequilibrium solvent effects on proton transfer processes through low-barrier hydrogen bonds Ruiz-Lopez MF, Oliva A, Tunon I, Bertran J Journal of Physical Chemistry A, 102(52), 10728, 1998 |
56 |
Selective oxidation of methanol by extra oxygen species on one-dimensional Mo rows of a Mo(112)-(1x2)-O surface Fukui K, Motoda K, Iwasawa Y Journal of Physical Chemistry B, 102(44), 8825, 1998 |
57 |
The Topology of Multidimensional Potential-Energy Surfaces - Theory and Application to Peptide Structure and Kinetics Becker OM, Karplus M Journal of Chemical Physics, 106(4), 1495, 1997 |
58 |
Electrostriction Effects on Electron-Transfer Reactions in Solution .1. Adiabatic Regime Jeon J, Kim HJ Journal of Chemical Physics, 106(14), 5979, 1997 |
59 |
Finding Transition-States Using Contangency Curves Ulitsky A, Shalloway D Journal of Chemical Physics, 106(24), 10099, 1997 |
60 |
Unified Reaction Valley Approach Mechanism of the Reaction Ch3+h-2-)Ch4+h Konkoli Z, Kraka E, Cremer D Journal of Physical Chemistry A, 101(9), 1742, 1997 |