Quantum wavepacket dynamics with trajectories: wavefunction synthesis along quantum paths

被引:112
|
作者
Wyatt, RE [1 ]
机构
[1] Univ Texas, Inst Theoret Chem, Austin, TX 78712 USA
[2] Univ Texas, Dept Biochem & Chem, Austin, TX 78712 USA
基金
美国国家科学基金会;
关键词
D O I
10.1016/S0009-2614(99)00921-5
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The quantum trajectory method (QTM) for wavepacket dynamics involves integration of the quantum hydrodynamic equations for fluid elements (particles) [C. Lopreore and R.E. Wyatt, Phys. Rev. Lett. 82 (1999) 5190]. In this study, it is shown how the wavefunction modulus and phase (action function) may be computed from information carried by the particles as they move along quantum trajectories. The action function is computed by integrating the quantum Lagrangian along the particle trajectories. For a model collinear reaction, plots are presented for the time evolving probability density, Lagrangian, and action function. (C) 1999 Elsevier Science B.V. All rights reserved.
引用
收藏
页码:189 / 197
页数:9
相关论文
共 50 条
  • [31] 'The 'Vector-Model' wavefunction: spatial description and wavepacket formation of quantum-mechanical angular momenta'
    Rakitzis, T. Peter
    Koutrakis, Michail E.
    Katsoprinakis, Georgios E.
    PHYSICA SCRIPTA, 2024, 99 (07)
  • [32] Quantum trajectory calculations for bipolar wavepacket dynamics in one dimension
    Park, Kisam
    Poirier, Bill
    Parlant, Gerard
    JOURNAL OF CHEMICAL PHYSICS, 2008, 129 (19):
  • [33] Semiclassical dynamics based on quantum trajectories
    Garashchuk, S
    Rassolov, VA
    CHEMICAL PHYSICS LETTERS, 2002, 364 (5-6) : 562 - 567
  • [34] Quantum wave packet dynamics with trajectories
    Lopreore, CL
    Wyatt, RE
    PHYSICAL REVIEW LETTERS, 1999, 82 (26) : 5190 - 5193
  • [35] Quantum Dynamics from Classical Trajectories
    Mattos, Rafael S.
    Mukherjee, Saikat
    Barbatti, Mario
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2024, 20 (18) : 7728 - 7743
  • [36] Semiclassical nonadiabatic dynamics with quantum trajectories
    Rassolov, VA
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2005, 230 : U2843 - U2843
  • [37] Quantum dynamics modeled by interacting trajectories
    Cruz-Rodriguez, L.
    Uranga-Pina, L.
    Martinez-Mesa, A.
    Meier, C.
    CHEMICAL PHYSICS, 2018, 503 : 39 - 49
  • [38] Semiclassical nonadiabatic dynamics with quantum trajectories
    Rassolov, VA
    Garashchuk, S
    PHYSICAL REVIEW A, 2005, 71 (03)
  • [39] Vortex dynamics and their interactions in quantum trajectories
    Wisniacki, D. A.
    Pujals, E. R.
    Borondo, F.
    JOURNAL OF PHYSICS A-MATHEMATICAL AND THEORETICAL, 2007, 40 (48) : 14353 - 14368
  • [40] Dynamics of quantum trajectories in chaotic systems
    Wisniacki, DA
    Borondo, F
    Benito, RM
    EUROPHYSICS LETTERS, 2003, 64 (04): : 441 - 447