Gazelle Book Services Limited.
White Cross Mills, Hightown, LANCASTER LA1 4XS, United Kingdom.
Telephone: +44(0)1524 68765
Fax: +44(0)1524 63232
Email: sales@gazellebooks.co.uk
Web: www.gazellebooks.co.uk
| Title: | Quantum Chemistry & Nuclear Resonance Spectroscopy Data of Natural & Synthetic Nanotechnological Materials with nd-Metal Atoms Participations
|
| Author: | Elmira I Yuryeva, Svyatoslav Gabuda & Rafael N Pletnev |
| ISBN: | 1600217486 : 9781600217487 |
| Illustrations: | tables & charts |
| Format: | Hardback |
| Size: | 180x260mm |
| Pages: | 91 |
| Weight: | .388 Kg. |
| Published: | Nova Science Publishers - June 2007 |
| List Price: | 96.99 Pounds Sterling |
| Availability: | In Print |
| Subjects: | CHEMISTRY |
This book reviews the modern state-of-the-art of the central problem of advanced material sciences related to the electron-nuclear interaction in solids stressed on the basic problem of the mutual influence of the fast electronic fluctuations and of slow movement of nuclei. Its main purpose is elucidation within modern solid state chemistry of the influence to the relationship between the crystal structure of a substance and its macroscopic properties.
Introduction; Methods of Calculations; Main Approximations; Features of Xa- Discrete Variation Method; Chemical Bond Parameters; Hyperfine Electronic-Nuclear Interaction Parameters; Test Calculation Results; Oxygen Systems; Isovalence Substitution; 63Cu, 139 La NMR and Chemical Bonds in Anion Deficite Perovskite LaCu0.81Ni0.19O2.5+d; 57Fe Mössbauer Parameters of Fe3+ ions in Variable Composition Chromospinelides; Mobility of Crystal Lattice Atoms; Spin-Pierles Transition in CuGeO3: Calculations of 63Cu NQR Frequencies; Oxygen Transport in YBa2Cu3O7-d and SrFeO3; Electron Correlations and Dynamics of Hydrogen Atoms in Crystalline Hydrates of ns-Element Vanadates; Non-oxygen Systems; The Stability of Pairwise Defects in 3C-SiC; Temperature Stability of Hemoglobin Active Sites; Van der Waals Dispersion Interactions and Orientation Diffusion of Octahedral Molecules; MX6 (M=Mo, W, U, S, Te; X=F, OH) in Crystals; Conclusion; Index.
