MONTE CARLO SIMULATION OF THE SURFACE REDOXMECHANISM OF WATER GAS SHIFT REACTION Ⅰ. CONVERSION OF ADSORBED OH TO OXYGEN ADATOM

被引：1

作者：

CUI Yong-Bin

REN Jie

WANG Xiu-Zhi

SUN Yu-Han

ZHONG Bing (State Key Laboratory of Coal Conversion Institute of Coal Chemistry

机构：

来源：

Journal of Natural Gas Chemistry | 1997年 / 02期

关键词：

Monte Carlo simulation; mechanism; water gas shift reaction;

D O I：

暂无

中图分类号：

TQ113 [氨和铵盐工业];

学科分类号：

0817 ;

摘要：

The surface redox mechanism of water gas shift reaction was explored by Monte Carlo simulation. The surface modeling with the consideration of experimental results reveals that the conversion of OH* to O* takes place primarily via an elementary step of the dissociation of OH* into O* and H*.

引用

页码：121 / 127

页数：7