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Radiation effects, computer experiments /
Radiation Effects Computer Experiments.
| Clasificación: | Libro Electrónico |
|---|---|
| Autor principal: | |
| Formato: | Electrónico eBook |
| Idioma: | Inglés |
| Publicado: |
Amsterdam ; New York : New York :
North-Holland Pub. Co. ; Elsevier Science Pub. Co. [distributor],
1983.
|
| Colección: | Defects in solids ;
v. 13. |
| Temas: | |
| Acceso en línea: | Texto completo |
Tabla de Contenidos:
- Front Cover; Radiation Effects Computer Experiments; Copyright Page; Preface; Table of Contents; Chapter 1. Introduction; 1.1 The computer experiment concept; 1.2 Defect production computer experiments; 1.3 Defect annealing computer experiments; 1.4 Defect property computer experiments; 1.5 Defect interaction computer experiments; 1.6 Nature of the book; 1.7 Plan of the book; Appendix A 1 Computer experiment utility; References; Chapter 2. Computer experiment methods; 2.1 Introduction; 2.2 Dynamical method; 2.3 Monte Carlo method; 2.4 Variational method; References (ch. 2)
- Appendix A2.1 Computational cell constructionAppendix A2.2 Periodic boundary conditions; Appendix A2.3 Elastic continuum boundary conditions; Appendix A2.4 Thermal crystal initial conditions; Appendix A2.5 Dynamical method integration schemes; Appendix A2.6 Time step change in a dynamical method program; Appendix A2.7 Force calculations; Appendix A2.8 Atom velocity damping at the computational cell boundary; Appendix A2.9 Firsov inelastic collision model for dynamical method programs; Appendix A2.10 Statistical sampling; Appendix A2.11 Multiply occupied atom sites; References (appendix A2)
- Chapter 3. Outline of defect properties computations3.1 Introduction; 3.2 Defect energies; 3.3 Configuration energy computation procedure; 3.4 Migration energy computation procedure; 3.5 Entropy calculations; 3.6 Metal models used in defect property example calculations; 3.7 Neighbor shells in bcc, fee and hep crystals; Appendix A3.1 bcc computational cell site maps; Appendix A3.2 fee computational cell site maps; Appendix A3.3 hep computational cell site maps; References; Chapter 4. Vacancies and divacancies; 4.1 Introduction; 4.2 Configuration and binding energies
- 4.3 Vacancy GE1% displacement field4.4 Divacancy GE1% displacement field; References; Chapter 5. Self interstitials; 5.1 Introduction; 5.2 Self interstitials in bcc iron(m); 5.3 Self interstitials in a fee metal; 5.4 Self interstitials in the hep metal(m); References; Chapter 6. Impurity atoms; 6.1 Introduction; 6.2 Substitutional metallic large impurity atom (LIA); 6.3 Substitutional metallic small impurity atom (SIA); 6.4 Helium; 6.5 Carbon; 6.6 Carbon(m)-vacancy and carbon(m)-interstitial complexes; 6.7 Helium complexes; References; Chapter 7. Defect migration; 7.1 Introduction
- 7.2 Vacancy migration7.3 Divacancy migration; 7.4 Self-interstitial migration; 7.5 Carbon(m) migration; 7.6 Helium(m) Migration; 7.7 Dynamical method simulation of defect migration; References; Chapter 8. Vacancy clusters; 8.1 Introduction; 8.2 Vacancy clusters in bcc iron(m); 8.3 Vacancy clusters in fee metals; 8.4 Vacancy clusters in the hep metal(m); 8.5 Heterogeneous nucleation of vacancy clusters and voids; References; Chapter 9. Interstitial clusters; 9.1 Introduction; 9.2 Interstitial clusters in fee iron(m); 9.3 Interstitial loops in fee iron(m)