Computational materials science : from basic principles to material properties
Computational Physics is now a discipline in its own right, comparable with theoretical and experimental physics. Computational Materials Science concentrates on the calculation of materials properties starting from microscopic theories. It has become a powerful tool in industrial research for desig...
Guardat en:
| Altres autors: | , , |
|---|---|
| Format: | Livre numérique |
| Idioma: | Anglais |
| Publicat: |
Berlin [etc.] :
Springer
[20..].
Cham : Springer Nature |
| Col·lecció: | Lecture notes in physics
642 |
| Matèries: | |
| Accés en línia: | Accès sur la plateforme de l'éditeur Accès sur la plateforme Istex Accès Université d'Orléans Accès INSA CVL |
| Nota: |
Archives Springer e-books (Licence nationale) Archives Springer e-books (Licence nationale) |
| Autres localisations: | Voir dans le Sudoc |
| Edition sous un autre format: | • Computational materials science, from basic principles to material properties, W. Hergert, A. Ernst, M. Däne (Eds.), Berlin, Springer-Verlag, 2004, 1 volume (XVI-320 p.), Lecture notes in physics, 3-540-21051-2 • Computational Materials Science, Texte imprimé, 9783642059179 • Computational Materials Science, Texte imprimé, 9783662144350 • Computational Materials Science, Texte imprimé, 9783662599853 |
Taula de continguts:
- Introduction
- Density Functional Theory and the Full-Potential Local-Orbital Approach
- Methods for Band Structure Calculations in Solids
- A Solid-State Theoretical Approach to the Optical Properties of Photonic Crystals
- Simulation of Active and Nonlinear Photonic Nanomaterials in the Finite-Difference Time-Domain Framework
- Symmetry Properties of Electronic and Photonic Band Structures
- From the Cluster to the Liquid: Ab initio Calculations on Realistic Systems Based on First-Principles Molecular Dynamics
- Magnetism, Structure and Interactions at the Atomic Scale
- Present-Day Achievements of Molecular Dynamics Simulations
- Computational Materials Science with 'Materials Studio': Applications in Catalysis
- Integration of Modelling at Various Length and Time Scales
- Simulation of Material Behaviour from the Engineering Viewpoint - Classical Approaches and New Trends
- Parallel Implementation Strategies for Algorithms from Scientific Computing
- Multi-Grid Methods - An Introduction.