Density functional theory of Cu-zeolite de-NOx catalysts

被引：0

作者：

Ford Motor Co, Dearborn, United States ^{[1
]}

机构：

来源：

Journal of Computer-Aided Materials Design | 1996年 / 3卷 / 1-3期

关键词：

Calculations - Catalysis - Catalysts - Copper compounds - Ion exchange - Nitrogen oxides - Zeolites;

D O I：

暂无

中图分类号：

学科分类号：

摘要：

Cu-exchanged zeolites, especially Cu-ZSM-5, are active catalysts for both the decomposition and the selective reduction of NOx from automobile exhaust under 'lean-burn' conditions. Recent progress in the modelling of exchanged Cu sites and their interactions with small molecules, based on DFT cluster calculations, is briefly reviewed.

引用

页码：210 / 212

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