Theories of Molecular Reaction Dynamics
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Theories of Molecular Reaction Dynamics
The Microscopic Foundation of Chemical Kinetics, Second Edition
Hansen, Flemming Y.; Henriksen, Niels E.
Oxford University Press
08/2024
464
Mole
9780198899273
15 a 20 dias
Descrição não disponível.
1: Introduction
PART I: Gas-phase dynamics
2: From microscopic to macroscopic descriptions
3: Potential energy surfaces
4: Bimolecular reactions, dynamics of collisions
5: Rate constants, reactive flux
6: Bimolecular reactions, transition-state theory
7: Unimolecular reactions
8: Microscopic interpretation of Arrhenius parameters
PART II: Condensed-phase dynamics
9: Introduction to condensed-phase dynamics
10: Static solvent effects, transition-state theory
11: Dynamic solvent effects, Kramers theory and beyond
PART III: Appendices
Appendix A: Statistical Mechanics
Appendix B: Microscopic reversibility and detailed balance
Appendix C: Cross sections in various frames
Appendix D: Classical mechanics, coordinate transformations
Appendix E: Small vibrations and normal mode coordinates
Appendix F: An Integral
Appendix G: Dynamics of random processes
Appendix H: Multidimensional integrals, Monte Carlo method
PART I: Gas-phase dynamics
2: From microscopic to macroscopic descriptions
3: Potential energy surfaces
4: Bimolecular reactions, dynamics of collisions
5: Rate constants, reactive flux
6: Bimolecular reactions, transition-state theory
7: Unimolecular reactions
8: Microscopic interpretation of Arrhenius parameters
PART II: Condensed-phase dynamics
9: Introduction to condensed-phase dynamics
10: Static solvent effects, transition-state theory
11: Dynamic solvent effects, Kramers theory and beyond
PART III: Appendices
Appendix A: Statistical Mechanics
Appendix B: Microscopic reversibility and detailed balance
Appendix C: Cross sections in various frames
Appendix D: Classical mechanics, coordinate transformations
Appendix E: Small vibrations and normal mode coordinates
Appendix F: An Integral
Appendix G: Dynamics of random processes
Appendix H: Multidimensional integrals, Monte Carlo method
Este título pertence ao(s) assunto(s) indicados(s). Para ver outros títulos clique no assunto desejado.
1: Introduction
PART I: Gas-phase dynamics
2: From microscopic to macroscopic descriptions
3: Potential energy surfaces
4: Bimolecular reactions, dynamics of collisions
5: Rate constants, reactive flux
6: Bimolecular reactions, transition-state theory
7: Unimolecular reactions
8: Microscopic interpretation of Arrhenius parameters
PART II: Condensed-phase dynamics
9: Introduction to condensed-phase dynamics
10: Static solvent effects, transition-state theory
11: Dynamic solvent effects, Kramers theory and beyond
PART III: Appendices
Appendix A: Statistical Mechanics
Appendix B: Microscopic reversibility and detailed balance
Appendix C: Cross sections in various frames
Appendix D: Classical mechanics, coordinate transformations
Appendix E: Small vibrations and normal mode coordinates
Appendix F: An Integral
Appendix G: Dynamics of random processes
Appendix H: Multidimensional integrals, Monte Carlo method
PART I: Gas-phase dynamics
2: From microscopic to macroscopic descriptions
3: Potential energy surfaces
4: Bimolecular reactions, dynamics of collisions
5: Rate constants, reactive flux
6: Bimolecular reactions, transition-state theory
7: Unimolecular reactions
8: Microscopic interpretation of Arrhenius parameters
PART II: Condensed-phase dynamics
9: Introduction to condensed-phase dynamics
10: Static solvent effects, transition-state theory
11: Dynamic solvent effects, Kramers theory and beyond
PART III: Appendices
Appendix A: Statistical Mechanics
Appendix B: Microscopic reversibility and detailed balance
Appendix C: Cross sections in various frames
Appendix D: Classical mechanics, coordinate transformations
Appendix E: Small vibrations and normal mode coordinates
Appendix F: An Integral
Appendix G: Dynamics of random processes
Appendix H: Multidimensional integrals, Monte Carlo method
Este título pertence ao(s) assunto(s) indicados(s). Para ver outros títulos clique no assunto desejado.
