1 |
Including anharmonicity in the calculation of rate constants. 1. The HCN/HNC isomerization reaction Isaacson AD Journal of Physical Chemistry A, 110(2), 379, 2006 |
2 |
Anharmonic effects on the transition state theory rate constant Isaacson AD Journal of Chemical Physics, 117(19), 8778, 2002 |
3 |
Removing resonance effects from quantum mechanical vibrational partition functions obtained from perturbation theory Isaacson AD Journal of Chemical Physics, 108(24), 9978, 1998 |
4 |
Calculation of rate constants for proton transfer between tethered oxygens Immaraporn B, Isaacson AD Journal of Physical Chemistry A, 102(1), 181, 1998 |
5 |
Harmonic and anharmonic rate constants and transmission coefficients obtained from ab initio data Isaacson AD Journal of Chemical Physics, 107(10), 3832, 1997 |
6 |
General-Method for Removing Resonance Singularities in Quantum-Mechanical Perturbation-Theory Kuhler KM, Truhlar DG, Isaacson AD Journal of Chemical Physics, 104(12), 4664, 1996 |
7 |
Use of 2nd-Order Perturbation-Theory for the Vibrational-Energy Levels and Partition-Functions at a Saddle-Point Isaacson AD, Hung SC Journal of Chemical Physics, 101(5), 3928, 1994 |