Quantum Chemistry Approaches to Chemisorption and Heterogeneous Catalysis
The development of "high-tech" materials in contemporary industries is deeply related to a detailed understanding of specific surface properties of catalysts which make particular reactions possible. But this understanding presupposes that there exists a body of theory capable of explainin...
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| Format: | eBook |
| Language: | English |
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Dordrecht
Springer Netherlands
1992, 1992
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| Edition: | 1st ed. 1992 |
| Series: | Understanding Chemical Reactivity
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| Subjects: | |
| Online Access: | |
| Collection: | Springer Book Archives -2004 - Collection details see MPG.ReNa |
Table of Contents:
- Ch. 1. A Generalized Valence Bond View of Chemisorption and Reactions on Transition Metal Surfaces
- Ch. 2. A Cluster Model for Reactions on Transition Metal Surfaces
- Ch. 3. Interaction op Transition Metal Clusters with Atoms, Molecules and Surfaces
- Ch. 4. Density Functional Theory in the Context of Local-Scaling Transformations and Its Prospects for Applications in Catalysis
- Ch. 5. Model Hamiltonian Approach to Adsorption Theory
- Ch. 6. Application of Mindo to Adsorption and Catalysis
- Ch. 7. Semiempirical Quantum-Chemical Studies of Catalysts with Transition Metals: Eht and Related Approaches
- Ch. Reaction Energetics on Transition Metal Surfaces: A Bond-Order Conservation Approach
- Ch. 9. Quantum Mechanical Calculations of Chemical Interactions Oon Transition Metal Surfaces