Trajectory driven second quantization approach to quantum dynamics

被引:4
作者
Billing, GD [1 ]
机构
[1] Univ Copenhagen, HC Orsted Inst, Dept Chem, Copenhagen 2200 O, Denmark
关键词
D O I
10.1016/S0301-0104(99)00046-4
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
We present a second quantization formulation of quantum dynamics and investigate the new formulation by solving the time-dependent Schrodinger equation for a three dimensional quantum system in two ways. Firstly by introducing a state expansion of the wave function in a Gauss-Hermite basis set and secondly by using the second quantization scheme derived by expanding the potential locally around trajectories. The system under investigation is that of a helium atom scattered from a copper surface. The complete system can by introducing a time-dependent Hartree approximation be reduced to that of solving a time-dependent Schrodinger equation for the motion of the helium atom in an effective time-dependent potential. (C) 1999 Elsevier Science B.V. All rights reserved.
引用
收藏
页码:341 / 351
页数:11
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