共 50 条
- [1] QUASICLASSICAL TRAJECTORY (AND VARIATIONAL TRANSITION-STATE THEORY) STUDY OF THE RATES AND TEMPERATURE-DEPENDENT ACTIVATION-ENERGIES OF THE REACTIONS MU+H2 (COMPLETELY THERMAL) AND H,D, AND MU+H2 (V=0,J=2) JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (05): : 2363 - 2367
- [2] GENERALIZED TRANSITION-STATE THEORY CALCULATIONS FOR THE REACTIONS D+H2 AND H+D2 USING AN ACCURATE POTENTIAL-ENERGY SURFACE - EXPLANATION OF THE KINETIC ISOTOPE EFFECT JOURNAL OF CHEMICAL PHYSICS, 1980, 72 (06): : 3460 - 3471
- [5] VARIATIONAL TRANSITION-STATE THEORY CALCULATIONS OF THE REACTION-RATES OF F WITH H2, D2, AND HD AND THE INTERMOLECULAR AND INTRAMOLECULAR KINETIC ISOTOPE EFFECTS JOURNAL OF CHEMICAL PHYSICS, 1985, 82 (12): : 5499 - 5505
- [7] COMPARISON OF VARIATIONAL TRANSITION-STATE THEORY AND QUANTUM SUDDEN CALCULATIONS OF 3-DIMENSIONAL RATE COEFFICIENTS FOR THE REACTIONS D(H)+BRH-]DBR(HBR)+H JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (02): : 777 - 782
- [8] A theoretical investigation of α-carbon kinetic isotope effects and their relationship to the transition-state structure of SN2 reactions JOURNAL OF ORGANIC CHEMISTRY, 2005, 70 (10): : 4022 - 4027