Reaction of SO2 with pure and metal-doped MgO: Basic principles for the cleavage of S-O bonds

被引：47
|
作者：
Rodriguez, J.A. [1 ]
Jirsak, T. [1 ]
González, L. [1 ]
Evans, J. [1 ]
Pérez, M. [1 ]
Maiti, A. [1 ]
机构：
[1] Department of Chemistry, Brookhaven National Laboratory, Upton, NY 11973, United States
来源：
Journal of Chemical Physics | 2001年 / 115卷 / 23期
关键词：
Cleavage - First principles density functional calculation - X ray absorption near-edge spectroscopy;
D O I：
10.1063/1.1416683
中图分类号：
学科分类号：
摘要：
(Edited Abstract)
引用
收藏
页码：10914 / 10926
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