화학공학소재연구정보센터
검색결과 : 8건
No. Article
1 Quantum mechanical canonical rate theory: A new approach based on the reactive flux and numerical analytic continuation methods
Rabani E, Krilov G, Berne BJ
Journal of Chemical Physics, 112(6), 2605, 2000
2 On the application of numerical analytic continuation methods to the study of quantum mechanical vibrational relaxation processes
Gallicchio E, Egorov SA, Berne BJ
Journal of Chemical Physics, 109(18), 7745, 1998
3 Semiclassical Approximations to Quantum Dynamical Time-Correlation Functions
Cao JS, Voth GA
Journal of Chemical Physics, 104(1), 273, 1996
4 Activated Rate-Processes - The Reactive Flux Method for One-Dimensional Surface-Diffusion
Bader JS, Berne BJ, Pollak E
Journal of Chemical Physics, 102(10), 4037, 1995
5 A Variational Centroid Density Procedure for the Calculation of Transmission Coefficients for Asymmetric Barriers at Low-Temperature
Messina M, Schenter GK, Garrett BC
Journal of Chemical Physics, 103(9), 3430, 1995
6 Can the Density Maximum of Water Be Found by Computer-Simulation
Billeter SR, King PM, Vangunsteren WF
Journal of Chemical Physics, 100(9), 6692, 1994
7 Accurate Quantum-Mechanics from High-Order Resummed Operator Expansions
Schwartz SD
Journal of Chemical Physics, 100(12), 8795, 1994
8 A New Formulation of Quantum Transition-State Theory for Adiabatic Rate Constants
Hansen NF, Andersen HC
Journal of Chemical Physics, 101(7), 6032, 1994