Quantum molecular dynamics of ultrafast processes in large polyatomic system's

被引：64

作者：

Jungwirth, P

Gerber, RB

机构：

[1] Acad Sci Czech Republic, J Heyrovsky Inst Phys Chem, CR-18223 Prague 8, Czech Republic

[2] Hebrew Univ Jerusalem, Dept Phys Chem, IL-91904 Jerusalem, Israel

[3] Hebrew Univ Jerusalem, Fritz Haber Res Ctr Mol Dynam, IL-91904 Jerusalem, Israel

[4] Univ Calif Irvine, Dept Chem, Irvine, CA 92697 USA

来源：

CHEMICAL REVIEWS | 1999年 / 99卷 / 06期

关键词：

D O I：

10.1021/cr9800210

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

The two-fold objectives of the review are: survey the method and computational approaches currently available for quantum treatment of chemical dynamics in many-atom systems, and illustrate how these theoretical tools are employed for the interpretation of the experiments. In addition to drawing the landscape of different existing methods with their successes and limitations, the interactions with experiments are discussed in detail. Some of the important open problems in the research and the possible directions of its future development are presented.

引用

页码：1583 / 1606

页数：24

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