TOPOLOGY AND MAXIMUM CONTENT OF ISOLATED SPECIES (AL, GA, FE, B, SI, ...) IN A ZEOLITIC FRAMEWORK - AN APPROACH TO ACID CATALYSIS

被引:86
作者
BARTHOMEUF, D
机构
[1] Laboratoire de Réactivité de Surface et Structure, URA 1106, Université Pierre et Marie Curie, 75252 Paris Cedex 05
关键词
D O I
10.1021/j100141a032
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
The use of a topological density makes possible the calculation of the maximum concentration of isolated atoms A with no second A neighbors in a framework containing two types of atoms (Al in Si-Al zeolites for instance) or three types (Si in SAPO's for example). The structures with the lowest topological density can accept the highest level of atom A in the isolated form. The results are related to the maxima obtained in acidity and catalysis as a function of A atoms concentration.
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页码:10092 / 10096
页数:5
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