화학공학소재연구정보센터
검색결과 : 14건
No. Article
1 Exact and asymptotic solutions of the mixed quantum-classical Liouville equation
Wan CC, Schofield J
Journal of Chemical Physics, 112(10), 4447, 2000
2 Consistent treatment of quantum-mechanical and classical degrees of freedom in mixed quantum-classical simulations
Muller U, Stock G
Journal of Chemical Physics, 108(18), 7516, 1998
3 Improvement of the adiabatic phase integral for the Landau-Zener-type curve crossing
Zhu CY, Nakamura H
Journal of Chemical Physics, 109(11), 4689, 1998
4 Simulation of coherent nonadiabatic dynamics using classical trajectories
Donoso A, Martens CC
Journal of Physical Chemistry A, 102(23), 4291, 1998
5 Nonadiabatic Transition and Energy Relaxation Dynamics in the Photoisomerization of S-Trans Butadiene
Ito M, Ohmine I
Journal of Chemical Physics, 106(8), 3159, 1997
6 Proton-Coupled Electron-Transfer Reactions in Solution - Molecular-Dynamics with Quantum Transitions for Model Systems
Fang JY, Hammesschiffer S
Journal of Chemical Physics, 106(20), 8442, 1997
7 Mean-Field Molecular-Dynamics with Surface Hopping
Prezhdo OV, Rossky PJ
Journal of Chemical Physics, 107(3), 825, 1997
8 Circular-Dichroism at Microwave-Frequencies - Calculated Rotational Strengths of Selected Transitions for Some Oxirane Derivatives
Salzman WR
Journal of Chemical Physics, 107(7), 2175, 1997
9 An Effective Hamiltonian-Based Method for Mixed Quantum-Classical Dynamics on Coupled Electronic Surfaces
Fang JY, Martens CC
Journal of Chemical Physics, 104(10), 3684, 1996
10 Nonadiabatic Transition-State Theory and Multiple Potential-Energy Surface Molecular-Dynamics of Infrequent Events
Hammesschiffer S, Tully JC
Journal of Chemical Physics, 103(19), 8528, 1995