Computer simulation of solids
Uloženo v:
| Další autoři: | , |
|---|---|
| Médium: | Livre numérique |
| Jazyk: | Anglais |
| Vydáno: |
Berlin [etc.] :
Springer
[20..].
Cham : Springer Nature |
| Edice: | Lecture notes in physics
166 |
| Témata: | |
| On-line přístup: | Accès sur la plateforme de l'éditeur Accès sur la plateforme Istex Accès Université d'Orléans Accès INSA CVL |
| Poznámka: |
Archives Springer e-books (Licence nationale) Archives Springer e-books (Licence nationale) |
| Autres localisations: | Voir dans le Sudoc |
| Edition sous un autre format: | • Computer simulation of solids, edited by C.R.A. Catlow and W.C. Mackrodt, Berlin, Springer, 1982, 1 volume (xii-320 pages), Lecture notes in physics, 3-540-11588-9 • Computer Simulation of Solids, Texte imprimé, 9783662172148 |
Obsah:
- Theory of simulation methods for lattice and defect energy calculations in crystals
- Theory and calculation of defect entropies
- Characteristic volumes of point defects in tonic crystals
- Free energy calculations for crystals
- Molecular dynamics simulations of crystalline ionic materials
- Ab initio cluster calculations for defects in the solid state
- Computational methods for the electronic structure of defects in insulators
- Interatomic potentials in solids
- Potentials in metals
- Interionic potentials in ionic solids
- Interatomic potentials in covalent and semi-covalent solids
- Defect calculations for ionic materials
- Point defect calculations in metals
- Defect calculations in semiconductors
- Computer modelling of complex and massively disordered crystalline solids
- Aspects of the chemistry of phyllosilicates and intercalation in vermiculites
- Aggregation and precipitation in alkali halides
- Computer simulation of fast ton conductors
- Computer simulation of ionic crystal surfaces
- Long range order in non-stoichiometric oxides.