Bohmian mechanics in the exact factorization of electron-nuclear wave functions

被引:22
|
作者
Suzuki, Yasumitsu [1 ]
Watanabe, Kazuyuki [1 ]
机构
[1] Tokyo Univ Sci, Dept Phys, Shinjuku Ku, 1-3 Kagurazaka, Tokyo 1628601, Japan
关键词
RESONANCE-ENHANCED IONIZATION; QUANTUM-CLASSICAL DYNAMICS; MOLECULAR-DYNAMICS; DISSOCIATIVE IONIZATION; H-2(+); LOCALIZATION; SIMULATIONS; TRANSITIONS; DENSITY; SYSTEMS;
D O I
10.1103/PhysRevA.94.032517
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
The exact factorization of an electron-nuclear wave function [A. Abedi, N. T. Maitra, and E. K. U. Gross, Phys. Rev. Lett. 105, 123002 (2010)] allows us to define the rigorous nuclear time-dependent Schrodinger equation (TDSE) with a time-dependent potential-energy surface (TDPES) that fully accounts for the coupling to the electronic motion and drives the nuclear wave-packet dynamics. Here, we study whether the propagation of multiple classical trajectories can reproduce the quantum nuclear motion in strong-field processes when their motions are governed by the quantum Hamilton-Jacobi equation derived by applying Bohmian mechanics to this exact nuclear TDSE. We demonstrate that multiple classical trajectories propagated by the force from the gradient of the exact TDPES plus the Bohmian quantum potential can reproduce the strong-field dissociation dynamics of a one-dimensional model of the H-2(+) molecule. Our results show that the force from the Bohmian quantum potential plays a non-negligible role in yielding quantum nuclear dynamics in the strong-field process studied here, where ionization and/or splitting of nuclear probability density occurs.
引用
收藏
页数:9
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