Metal-Ligand Interactions

ISBN 10: 1402014953 / ISBN 13: 9781402014956

Editore: Springer, 2003

pp. 612 100 Illus. Codice articolo 6814954

Riassunto:

The emphasis in this book is on problems related to crossing the boundary from molecular systems to nano, macro and micro-scale materials and to the effects of the environment on the properties of the molecular systems. The following fields are discussed:

metal clusters;

inorganic complexes and materials;

surface phenomena;

adsorption and catalysis;

organic and bioorganic systems;

ab initio theory;

density functional theory;

classical and quantum dynamics. £/List£ The book presents a broad view of current theoretical, experimental and applied findings in all fields in which the metal-ligand interaction plays a significant role.

Contenuti: Preface. List of Contributors. On the Use of Density Functional Theory in the Study of Metal-Ligand Interactions. Some Studied Cases; M. Belcastro, et al. Metal Binding to Prion Protein; R.P. Bonomo, et al. Functional Mimics of Cu, Zn-Superoxide Dismutase Enzyme; R.P. Bonomo, et al. From Real World Catalysis to Surface Science and Back: Can Nanoscience Help to Bridge the Gap? H.-J. Freund, et al. Cyclopalladated Complexes: a New Class of Highly Efficient Single Component Photorefractive Materials; M. Ghedini, et al. Substituted-8-hydroxyquinolines Metal Complexes for Application in Organic Light Emitting Devices; M. Ghedini, et al. Metal Clusters and Metallicity: the Paradigm of Magnesium; J. Jellinek, P.H. Acioli. Chemical Reactivity of Free and Supported Metal Clusters; K. Judai, et al. Microscopic DNA Fluctuations are in Accord with Macroscopic DNA Stretching Elasticity without Strong Dependence on Force-field Choice; J. Marko, et al. Electron Correlation: Quantum Chemistry's Holy Grail; J.M. Mercero, et al. What Can Tell Topological Approaches on the Bonding in Transition Metal Compounds; B. Silvi, et al. Metal-DNA Interactions; T. Theophanides, et al. Possible Electronic Modifications of VO-Based Catalysts; M. Witko, et al. Electronic Properties, Spectroscopic Properties and Monomolecular Isomerization Processes of Prototype Oled Compound Alauminium Tris(quinolin-8-olate) Facial and Meridianal Isomers; M. Amati, F. Lelj. Molecular-Level Machines: the Clockwork Model; L. Bencze, et al. DFT-Investigations of Intermediates in Catalytic Reactions; H. Bögel. Molecular Modelling of Copper Sites in ZSM-5: DFT and IR Studies on the Properties of Cu2+ and Cu+ Centres and Their Interaction with NO; E. Broclawik, et al. DFT-IET Method forQuantum-Classical Systems: Treatment of Solvated Quasiparticles; G.N. Chuev, et al. Cylindrical-Wave Method in Theory of Pristine and Metal-Doped Nanotubes and Nanowires; P.N. D'yachkov. Charge-Transfer in DNA-Metal-Ligand Complexes. Polynucleotides; N.S. Fialko, V.D. Lakhno. DFT Based Reactivity Descriptors and Their Application to Study of Organotin Compounds; P. Geerlings, et al. Recent Research results in the Laboratory of Inorganic Chemistry of the University of Ioannina-Greece; N. Hadjiliadis. The Hydrogen Bonding in DNA vs. Unnatural Base Pairs; E.S. Kryachko. Charge Transfer in DNA-Metal-Ligand Complexes. Oligonucleotides; V.D. Lakhno. Index. List of Participants.

Dati bibliografici

Titolo: Metal-Ligand Interactions
Casa editrice: Springer
Data di pubblicazione: 2003
Legatura: Brossura
Condizione: New