The Study of Reactive Intermediates in Condensed Phases

被引：83

作者：

Carpenter, Barry K. ^{[1
]}

Harvey, Jeremy N. ^{[2
]}

Orr-Ewing, Andrew J. ^{[3
]}

机构：

[1] Cardiff Univ, Sch Chem, Pk Pl, Cardiff CF10 3AT, S Glam, Wales

[2] Katholieke Univ Leuven, Dept Chem, Celestijnen Laan 200F, B-3001 Heverlee, Belgium

[3] Univ Bristol, Sch Chem, Cantocks Close, Bristol BS8 1TS, Avon, England

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 2016年 / 138卷 / 14期

关键词：

DYNAMIC PATH BIFURCATION; MAPPING ATOMIC MOTIONS; NONSTATISTICAL DYNAMICS; MOLECULAR-DYNAMICS; PHOTOELECTRON-SPECTROSCOPY; SOLVATION DYNAMICS; TRANSITION-STATE; VIBRATIONAL-RELAXATION; INFRARED-SPECTROSCOPY; ULTRABRIGHT ELECTRONS;

D O I：

10.1021/jacs.6b01761

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

Novel experimental techniques and computational methods have provided new insight into the behavior of reactive intermediates in solution. The results of these studies show that some of the earlier ideas about how reactive intermediates ought to behave in solution were incomplete or even incorrect. This Perspective summarizes the new experimental and computational methods and draws attention to the shortcomings that their application has brought to light in previous models. Key areas needing further research are highlighted.

引用

页码：4695 / 4705

页数：11

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