Comparison of models for calculating the RRKM unimolecular rate constant k(E, J)
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[1] R. Marcus,et al. On the Statistical Theory of Unimolecular Processes , 2007 .
[2] R. Parson. Coriolis‐induced vibrational energy transfer in D2CO–D2CO collisions: A classical perspective , 1989 .
[3] C. Martens. Vibration–rotation interaction in the rigid bender: A quantum mechanical phase space view , 1989 .
[4] H. Neusser. Lifetimes of energy and angular momentum selected ions , 1989 .
[5] D. Lu,et al. Monoenergetic unimolecular rate constants and their dependence on pressure and fluctuations in state-specific unimolecular rate constants , 1989 .
[6] D. Lu,et al. Sensitivity of unimolecular lifetime distributions and energy dependent rate constants to fluctuations in state specific rate constants , 1989 .
[7] Darin C. Burleigh,et al. Rotation–vibration interactions between the two lowest frequency modes in formaldehyde , 1988 .
[8] B. Sumpter,et al. Interaction of molecular rotation with large-amplitude internal motions: a rigid twister model of hydrogen peroxide , 1988 .
[9] J. D. Mcdonald,et al. Rovibrational state mixing in the aldehyde C–H stretch fundamental region of acetaldehyde , 1988 .
[10] D. Leitner,et al. Particles-on-a-sphere method for computing the rotational-vibrational spectrum of H2O , 1988 .
[11] R. B. Shirts. Reply to Comment on ‘‘Decoupling of the local mode stretching vibrations of water through rotational excitation. I. Quantum mechanics’’ , 1988 .
[12] G. Natanson. Comment on ‘‘Decoupling of the local mode stretching vibrations of water through rotational excitation. I. Quantum mechanics’’ , 1988 .
[13] S. Lin,et al. Production and unimolecular decay rate of rotationally selected polyatomic molecular ions , 1988 .
[14] D. Leitner,et al. Theoretical intensities for rotation-vibration lines of water using particles-on-a-sphere wavefunctions , 1988 .
[15] C. Schlier,et al. Potential anisotropy and the lifetime of triatomic collision complexes , 1988 .
[16] M. Dubey,et al. Statistical intramolecular vibration–rotation energy transfer in isolated polyatomic molecules: Electric deflection studies , 1988 .
[17] B. Sumpter,et al. Semiclassical rotation-vibration energies for a triatomic molecule: H2O , 1987 .
[18] M. Gordon,et al. Potential primary pyrolysis processes of methylsilane , 1987 .
[19] C. Schlier. Angular momentum dependence of unimolecular decay in a triatomic system , 1987 .
[20] R. B. Shirts. Decoupling of the local mode stretching vibrations of water through rotational excitation. I. Quantum mechanics , 1986 .
[21] G. S. Ezra. INTERACTION BETWEEN BENDING VIBRATIONS AND MOLECULAR ROTATION: A MODEL STUDY , 1986 .
[22] G. McClelland,et al. Nonlinear dynamics of vibration–rotation interactions: Rigid bender H2O , 1986 .
[23] G. McClelland,et al. Fluorescence polarization from 1B1 pyrimidine: Evidence for intramolecular vibration–rotation energy transfer in a highly excited molecule , 1986 .
[24] R. Escribano,et al. Rotation-vibration separability in the classical motion of triatomics , 1986 .
[25] R. Berry,et al. Calculation of rovibrational spectra of water by means of particles‐on‐concentric‐spheres models. II. Excited states of stretching vibrations , 1986 .
[26] G. McClelland,et al. Semiclassical quantization of the vibration‐rotation problem , 1986 .
[27] M. Wolfsberg,et al. Variational calculations of rotational−vibrational energy levels of formaldehyde X~1A1 , 1985 .
[28] J. L. Kinsey,et al. Fluorescence and stimulated emission S1 → S0 spectra of acetylene: Regular and ergodic regions , 1985 .
[29] G. McClelland,et al. Classical trajectory study of vibration-rotation interaction in highly excited triatomic molecules , 1985 .
[30] W. Hase. On non-exponential unimolecular dissociation of molecules prepared by vibrational overtone excitation , 1985 .
[31] J. L. Kinsey,et al. Intramolecular vibrational dynamics including rotational degrees of freedom: Chaos and quantum spectra , 1985 .
[32] W. B. Clodius,et al. Enhancement of intramolecular vibrational energy transfer through rotational coupling , 1984 .
[33] R. Berry,et al. Calculation of rovibrational spectra of water by means of particles‐on‐concentric‐spheres models. I. Ground stretching vibrational state , 1984 .
[34] H. Schlegel,et al. Resolution of a paradox concerning the forward and reverse rate constants for ethyl .dblarw. atomic hydrogen + ethylene , 1982 .
[35] S. Stein,et al. Accurate evaluation of internal energy level sums and densities including anharmonic oscillators and hindered rotors , 1973 .
[36] J. H. Current,et al. Decomposition of Chemically Activated Ethyl‐d3 Radicals. Primary Intramolecular Kinetic Isotope Effect in a Nonequilibrium System , 1963 .
[37] F. W. Schneider,et al. The Thermal Unimolecular Isomerization of Methyl Isocyanide. Fall-of Behaviour , 1962 .