Structure-Activity and Selectivity Relationships in Heterogeneous Catalysis -

Structure-Activity and Selectivity Relationships in Heterogeneous Catalysis (eBook)

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1991 | 1. Auflage
363 Seiten
Elsevier Science (Verlag)
978-0-08-088719-7 (ISBN)
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Structure plays an important role in heterogeneous catalysis. It provides a framework for the arrangement and stragetic placement of key catalytic elements, hosting them in a prescribed manner so that their respective electronic properties can exhibit their desired catalytic functions and mutual interactions. Under reaction conditions these framework structures and their catalytic guests undergo dynamic processes becoming active participants of the overall catalytic process. They are not mere static geometric forms. The dynamics of catalytic structures are particularly vivid in selective oxidation catalysis where the lattice of a given catalytic solid partakes as a whole, not only its surface, in the redox processes of the reaction. The catalyst becomes actually a participating reagent. By proper choice of key catalytic elements and their host structures, preferred catalytic pathways can be selected over less desired ones. However, not only in selective redox catalysis does structure play an important role, its importance is also well documented, among others, in shape selective zeolite catalysis, enantioselective hydrogenation and hydrodesulfurization.


The contributions presented in this book address the dynamic character of the solid state under catalytic reaction conditions. By relating structure to activity and selectivity in heterogeneous catalysis our understanding of such correlations has been significantly enhanced through the use of sophisticated spectroscopic means, surface science and modeling.


Structure plays an important role in heterogeneous catalysis. It provides a framework for the arrangement and stragetic placement of key catalytic elements, hosting them in a prescribed manner so that their respective electronic properties can exhibit their desired catalytic functions and mutual interactions. Under reaction conditions these framework structures and their catalytic guests undergo dynamic processes becoming active participants of the overall catalytic process. They are not mere static geometric forms. The dynamics of catalytic structures are particularly vivid in selective oxidation catalysis where the lattice of a given catalytic solid partakes as a whole, not only its surface, in the redox processes of the reaction. The catalyst becomes actually a participating reagent. By proper choice of key catalytic elements and their host structures, preferred catalytic pathways can be selected over less desired ones. However, not only in selective redox catalysis does structure play an important role, its importance is also well documented, among others, in shape selective zeolite catalysis, enantioselective hydrogenation and hydrodesulfurization. The contributions presented in this book address the dynamic character of the solid state under catalytic reaction conditions. By relating structure to activity and selectivity in heterogeneous catalysis our understanding of such correlations has been significantly enhanced through the use of sophisticated spectroscopic means, surface science and modeling.

Front Cover 1
Structure–Activity and Selectivity Relationships in Heterogeneous Catalysis 4
Copyright Page 5
Contents 6
Preface 10
Acknowledgment 11
PART I: OXIDATION 12
Chapter 1. Redox dynamics and structure/activity relationships of vanadium-oxide on TiO2 catalyst 12
Chapter 2. Molecular structure-reactivity relationships of supported vanadium oxide catalysts 24
Chapter 3. Relative influence of structure and reactivity of V- and Mo-containing catalysts in mild oxidation of hydrocarbons 32
Chapter 4. Key structure-activity relationships in the vanadium phosphorus oxide catalyst system 42
Chapter 5. Structure-activity relationships in the oxidation of alkylaromatics over metal oxides 54
Chapter 6. Catalyst oxide support oxide interaction to prepare multifunctional oxidation catalysts 68
Chapter 7. Structural-sensitivity in propylene mild oxidation on new [100] oriented MoO3, catalysts 78
Chapter 8. A comparison between low and high temperature Bi2O3.MoO3 phases for 1-butene reactions 88
Chapter 9. Surface- and bulk-type catalysis of heteropolymolybdates. Importance of the concept in the structure-activity relationships for catalyst desing 98
Chapter 10. Active iron OxO centers for the selective catalytic oxidation of alkanes 110
Chapter 11. The oxidative coupling of methane over Sm2O3 and La2O3 128
Chapter 12. Effects of metal particle size and carbon fouling on the rate of heptane oxidation over platinum 138
Chapter 13. Structure/function relations in transition metal sulfide catalysts 148
PART II: HYDROGENATION 158
Chapter 14. Enantioselective hydrogenation of ethyl pyruvate: effect of catalyst and modifier structure 158
Chapter 15. Non-stoichiometry, a key to modify the activity and selectivity of spinel-type catalysts for hydrogenation reactions 168
Chapter 16. Supported metal catalysts prepared from amorphous metal alloys 180
PART III: ZEOLITE CATALYSIS 190
Chapter 17. Structure sensitivity in zeolite catalysts 190
Chapter 18. Conformational effects in heterogeneous catalysis 204
Chapter 19. Effects of morphology and electronic structure on the catalysis of zeolite encaged palladium particles 214
Chapter 20. Fundamental characteristics of the catalyst system platinum-loaded zeolite L 222
Chapter 21. Cation induced changes in chemical reactivity of small metal particles 232
Chapter 22. Structure-reactivity relationships in methanol to olefin conversion on various microporous crystalline catalysts 244
Chapter 23. Titanium silicalite: a new selective oxidation catalyst 254
Chapter 24. Potential of zeolites as catalysts in organic synthesis 268
PART IV: SURFACE SCIENCE AND MODELING 284
Chapter 25. The influence of surface defect sites on chemisorption and catalysis 284
Chapter 26. Correlations between structure and reactivity of metal surfaces 302
Chapter 27. Alkyl iodides on copper surfaces: C-H activation and coupling reactions of hydrocarbon fragments to produce ethylene 312
Chapter 28. Effects of halogens on oxidation reactions over single crystals of palladium 320
Chapter 29. Small molecule reactions on clean and modified iron surfaces 326
Chapter 30. Structure-activity and structure-selectivity relations for reactions of carboxylic acids on TiO2 (001) surfaces 338
Chapter 31. Surface chemistry modelling of Ziegler-Natta catalysis 348
Chapter 32. Mathematical description of heterogeneous materials -effect of the branching direction 358
Author Index 370
Studies in Surface Science and Catalysis (Other Volumes in the Series) 372

Erscheint lt. Verlag 9.7.1991
Sprache englisch
Themenwelt Naturwissenschaften Chemie Anorganische Chemie
Naturwissenschaften Chemie Organische Chemie
Naturwissenschaften Chemie Physikalische Chemie
Naturwissenschaften Chemie Technische Chemie
Technik Umwelttechnik / Biotechnologie
ISBN-10 0-08-088719-8 / 0080887198
ISBN-13 978-0-08-088719-7 / 9780080887197
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