Title | Critical Comparison of Approximate and Accurate Quantum-mechanical Calculations of Rate Constants for a Model Activated Reaction in Solution |
Publication Type | Journal Article |
Year of Publication | 1992 |
Authors | McRae, RP, Schenter, GK, Garrett, BC, Haynes, GR, Voth, GA, Schatz, GC |
Journal | The Journal of Chemical Physics |
Volume | 97 |
Pagination | 7392-7404 |
Keywords | QUANTUM MECHANICS ACCURACY SOLUTIONS CHEMICAL REACTION KINETICS VARIATIONAL METHODS CORRECTIONS SEMICLASSICAL APPROXIMATION FEYNMAN PATH INTEGRAL HARMONIC OSCILLATORS |
DOI | 10.1063/1.463511 |