ABINITIO MOLECULAR-ORBITAL CALCULATIONS ON THE ACIDIC PROPERTIES OF BORALITE

被引：19

作者：

OMALLEY, PJ

DWYER, J

机构：

来源：

JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS | 1987年 / 02期

关键词：

D O I：

10.1039/c39870000072

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：72 / 73

页数：2

共 10 条

[1] ISOMORPHOUS SUBSTITUTION IN ZEOLITE FRAMEWORKS .1. ACIDITY OF SURFACE HYDROXYLS IN [B]-ZSM-5, [FE]-ZSM-5, [GA]-ZSM-5, AND [AL]-ZSM-5 [J].

CHU, CTW ;

CHANG, CD .

JOURNAL OF PHYSICAL CHEMISTRY, 1985, 89 (09) :1569-1571

[2]

GEERLINGS P, 1984, J PHYS CHEM-US, V88, P5572

[3]

Gibbs G.V., 1981, STRUCT BOND CRYST, P195, DOI DOI 10.1016/B978-0-12-525101-3.50015-2

[4] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .22. SMALL SPLIT-VALENCE BASIS-SETS FOR 2ND-ROW ELEMENTS [J].

GORDON, MS ;

BINKLEY, JS ;

POPLE, JA ;

PIETRO, WJ ;

HEHRE, WJ .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (10) :2797-2803

[5] EFFECT OF HYDRATION ON THE LOCAL SYMMETRY AROUND ALUMINUM IN ZSM-5 ZEOLITES STUDIED BY AL-27 NUCLEAR MAGNETIC-RESONANCE [J].

KENTGENS, APM ;

SCHOLLE, KFMGJ ;

VEEMAN, WS .

JOURNAL OF PHYSICAL CHEMISTRY, 1983, 87 (22) :4357-4360

[6] BRIDGING AND TERMINAL HYDROXYLS - A STRUCTURAL CHEMICAL AND QUANTUM CHEMICAL DISCUSSION [J].

MORTIER, WJ ;

SAUER, J ;

LERCHER, JA ;

NOLLER, H .

JOURNAL OF PHYSICAL CHEMISTRY, 1984, 88 (05) :905-912

[7]

NEWTON MD, 1981, STRUCTURE BONDING CR, V1, P175

[8] CRYSTAL STRUCTURE OF ZEOLITE HYDROGEN FAUJASITE [J].

OLSON, DH ;

DEMPSEY, E .

JOURNAL OF CATALYSIS, 1969, 13 (02) :221-+

[9] PROTON MAGIC ANGLE SPINNING NUCLEAR MAGNETIC-RESONANCE AND TEMPERATURE PROGRAMMED DESORPTION STUDIES OF AMMONIA ON THE ACIDITY OF THE FRAMEWORK HYDROXYL-GROUPS IN THE ZEOLITE H-ZSM-5 AND IN H-BORALITE [J].

SCHOLLE, KFMGJ ;

KENTGENS, APM ;

VEEMAN, WS ;

FRENKEN, P ;

VANDERVELDEN, GPM .

JOURNAL OF PHYSICAL CHEMISTRY, 1984, 88 (01) :5-8

[10] THE INFLUENCE OF HYDRATION ON THE COORDINATION STATE OF BORON IN H-BORALITE STUDIED BY B-11 MAGIC ANGLE SPINNING NMR [J].

SCHOLLE, KFMGJ ;

VEEMAN, WS .

ZEOLITES, 1985, 5 (02) :118-122

← 1 →