m-dinitrobenzene in zeolite NaY: Four different arrangements

被引：21

作者：

Kirschhock, C

Fuess, H

机构：

[1] Fachbereich Materialwissenschaft, Fachgebiet für Strukturforschung TH Darmstadt, D-64287 Darmstadt

来源：

ZEOLITES | 1996年 / 17卷 / 04期

关键词：

m-dinitrobenzene; NaY; power diffraction; Rietveld refinement; force field simulation;

D O I：

10.1016/0144-2449(96)00035-8

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 arrangement of m-dinitrobenzene in NaY was investigated by powder diffraction methods. Adsorption sites vary with content of guest molecules, presence of water, and sample preparation. A strong correlation of the cation distribution with the molecular positions was detected. Additional force field simulation of the molecular positions is presented

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页码：381 / 388

页数：8

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