NEW APPROACH TO QUANTUM DYNAMICS - RECURSIVE, AVERAGE-CASE COMPLEXITY, DISTRIBUTED APPROXIMATING FUNCTIONAL METHOD FOR TIME-INDEPENDENT WAVEPACKET FORMS OF SCHRODINGER AND LIPPMANN-SCHWINGER EQUATIONS

被引:5
作者
HUANG, YH
KOURI, DJ
HOFFMAN, DK
机构
[1] UNIV HOUSTON, DEPT PHYS, HOUSTON, TX 77204 USA
[2] IOWA STATE UNIV SCI & TECHNOL, DEPT CHEM, AMES, IA 50011 USA
[3] IOWA STATE UNIV SCI & TECHNOL, AMES LAB, AMES, IA 50011 USA
关键词
D O I
10.1016/0009-2614(95)00407-U
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
A new approach to quantum dynamics is presented which addresses the fundamental difficulty of exponential growth of computational complexity with the dimensionality of the system. A general recursive polynomial treatment of the time-independent full Green operator, the average-case complexity approach to multi-dimensional integration, and the continuous distributed approximating functional representation of the Hamiltonian are the three ingredients of the approach. Calculations for collinear H + H-2 reactive scattering are presented to illustrate the method.
引用
收藏
页码:387 / 394
页数:8
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