Effects of Ligands, Cluster Size, and Charge State in Gas-Phase Catalysis: A Happy Marriage of Experimental and Computational Studies

被引：128

作者：

Schlangen, Maria ^{[1
]}

Schwarz, Helmut ^{[1
,2
]}

机构：

[1] Tech Univ Berlin, Inst Chem, D-10623 Berlin, Germany

[2] King Abdulaziz Univ, Fac Sci, Jeddah 21589, Saudi Arabia

来源：

CATALYSIS LETTERS | 2012年 / 142卷 / 11期

关键词：

Bond activation; Catalysis; Transition metals; Reaction mechanisms; Elementary steps; H BOND ACTIVATION; NAKED METAL CLUSTER; MASS-SPECTROMETRY; THERMAL-ACTIVATION; METHANE ACTIVATION; CO OXIDATION; FREE GOLD; MECHANISTIC INSIGHTS; OXIDE CATIONS; HCN SYNTHESIS;

D O I：

10.1007/s10562-012-0892-3

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 selected examples of gas-phase reactions which are of timely interest for the activation of small molecules. Due to the very nature of the experiments, detailed insight in the active site of catalysts is provided and-in combination with computational chemistry-mechanistic aspects of as well as the elementary steps involved in the making and breaking of chemical bonds are revealed.

引用

页码：1265 / 1278

页数：14

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