QUANTUM-MECHANICAL CALCULATIONS ON MOLECULAR-SIEVES .1. PROPERTIES OF THE SI-O-SI, SI-O-AL, SI-O-B BRIDGE IN ZEOLITES

被引：61

作者：

DEROUANE, EG ^{[1
]}

FRIPIAT, JG ^{[1
]}

机构：

[1] MOBIL RES & DEV CORP,CENT RES LABS,PRINCETON,NJ 08540

来源：

JOURNAL OF PHYSICAL CHEMISTRY | 1987年 / 91卷 / 01期

关键词：

D O I：

10.1021/j100285a032

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：

引用

页码：145 / 148

页数：4

共 24 条

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CHU, CTW ;

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ANDRE, JM ;

DEROUANE, EG .

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[8] A NONEMPIRICAL MOLECULAR-ORBITAL STUDY OF THE SITING AND PAIRING OF ALUMINUM IN FERRIERITE [J].

FRIPIAT, JG ;

GALET, P ;

DELHALLE, J ;

ANDRE, JM ;

NAGY, JB ;

DEROUANE, EG .

JOURNAL OF PHYSICAL CHEMISTRY, 1985, 89 (10) :1932-1937

[9] A MOLECULAR-ORBITAL STUDY OF BOND LENGTH AND ANGLE VARIATIONS IN FRAMEWORK STRUCTURES [J].

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[10]

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