Molecular heterogeneous catalysis

作者: Matthew Neurock , Rutger Anthony Van Santen

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摘要: Preface. 1. Introduction. 2. Principles of Molecular Heterogeneous Catalyis. 3. The Reactivity Transition-Metal Surfaces. 4. Shape Selective Microporous Catalysts, the Zeolithes. 5. Catalysis by Oxides and Sulfides. 6. Mechanisms for Aqueous Phase Electrocatalysis. 7. in Biocatalysis. Relationship with Chemocatalysis. 8. Self Organization Assembly Catalytic Systems. 9. Origin Life, Biomineralization. 10. Postscript. Appendix: A: Electronic Structure Methods. Appendix B: Atomic/Molecular Simulation. C: Simulating Kinetics. Index.

参考文章(2)
Axel Groß, Theoretical Surface Science Theoretical Surface Science. ,(2003) , 10.1007/978-3-540-68969-0
G. Kresse, J. Furthmüller, Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set Computational Materials Science. ,vol. 6, pp. 15- 50 ,(1996) , 10.1016/0927-0256(96)00008-0