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Computational materials science / |
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Bibliographical information (record 127465) |
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Computational materials science / |
Publisher: |
Ohmsha,
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| ISBN: |
1586033352 (IOS Press : hd. bd.)
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Edition: |
c2003.
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Classification: |
TA404.23 |
Dewey: |
620.1 |
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- "Published in cooperation with NATO Scientific Affairs Division."
- "Proceedings of the NATO Advanced Study Institute on Computational Materials Science, 9-22 September 2001, Il Ciocco, Italy"--T.p. verso.
- Includes bibliographical references and index.
- Computer Modelling of Materials: an Introduction /
- Richard Catlow --
- Methods of Electronic Structure Calculation /
- A. V. Postnikov --
- An Introduction to Density Functional Theory /
- N. M. Harrison --
- Hartree-Fock Method /
- I. V. Abarenkov --
- On the Performance of Various Hamilitonians in the Study of Crystalline Compounds: the Case of Open Shell Systems /
- G. Mallia, R. Orlando, M. Llunell and R. Dovesi --
- Translation Symmetry in Imperfect Crystal Modelling /
- R. A. Evarestov --
- Vibrations in Solids and Small Particles from First-Principles Calculations /
- A. V. Postnikov --
- Quantum Chemical Approach to Excited States in Material Science /
- Coen de Graaf, Carmen Sousa and Francesc Illas --
- Computer Simulations of Polar Oxide Surfaces /
- Fabio Finocchi, Francois Bottin and Claudine Noguera --
- Computer Simulation of Surface of Metals and Metal-Oxide Materials /
- Nora H. de Leeuw, Timothy G. Cooper, Christopher J. Nelson, Donald Mkhonto and Phuti E. Ngoepe --
- Surface Relaxation in Solids and Nanoparticles /
- A. V. Postnikov --
- Semiconductors I: Methods of Calculating Point Defects in Semiconductors /
- Peter Deak --
- Semiconductors II: Tips for Modelling Point Defects in Semiconductors /
- Peter Deak --
- Modeling of Point Defects, Polarons and Excitons in Ferroelectric Perovskites /
- E. A. Kotomin, R. I. Eglitis, G. Borstel and P. W. M. Jacobs --
- Modelling Point Defects and Diffusion in Earth Materials /
- Kate Wright --
- Molecular Dynamics Simulations of Silicate Glasses /
- A. N. Cormack --
- Molecular Mechanism of Ethylene Epoxidation on Silver: State of the Problem, and Theoretical Approaches /
- Georgii M. Zhidomirov, Vasilii I. Avdeev and Andrei I. Boronin --
- Atomistic Measures of Materials Strength and Deformation /
- Ju Li, Wei Cai, Jinpeng Chang and Sidney Yip --
- Integrated Approach to Atomistic Simulation of Film Deposition Processes /
- Alexander A. Bagatur'yants, Anatoli A. Korkin, Konstantin P. Novoselov, Leonid L. Savchenko and Stanislav Ya. Umanskii.
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Barcode |
Status |
Library |
Section |
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3355971003
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Item available
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NEU Grand Library2nd Floor (TA404.23 .N38 2003)
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General Collection |
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