Theories of molecular reaction dynamics: the microscopic foundation of chemical kinetics
This book deals with a central topic at the interface of chemistry and physicsthe understanding of how the transformation of matter takes place at the atomic level. Building on the laws of physics, the book focuses on the theoretical framework for predicting the outcome of chemical reactions. The st...
Gespeichert in:
| Hauptverfasser: | , |
|---|---|
| Format: | Buch |
| Sprache: | English |
| Veröffentlicht: |
Oxford
Oxford University Press
2019
|
| Ausgabe: | Second edition |
| Schriftenreihe: | Oxford graduate texts
|
| Schlagworte: | |
| Zusammenfassung: | This book deals with a central topic at the interface of chemistry and physicsthe understanding of how the transformation of matter takes place at the atomic level. Building on the laws of physics, the book focuses on the theoretical framework for predicting the outcome of chemical reactions. The style is highly systematic with attention to basic concepts and clarity of presentation. The emphasis is on concepts and insights obtained via analytical theories ratherthan computational and numerical aspects.Molecular reaction dynamics is about the detailed atomic-level description of chemical reactions. Based on quantum mechanics and statistical mechanics, the dynamics of uni- and bi-molecular elementary reactions are described. The book features a comprehensive presentation of transition-state theory which plays an important role in practice, and a detailed discussion of basic theories of reaction dynamics in condensed phases. Examples and end-of-chapter problems are included in order toillustrate the theory and its connection to chemical problems.The second edition includes updated descriptions of adiabatic and non-adiabatic electron-nuclear dynamics, an expanded discussion of classical two-body models of chemical reactions, including the Langevin model, additional material on quantum tunnelling and its implementation in Transition-State Theory, and a more thorough description of the Born and Onsager models for solvation. |
| Beschreibung: | xiii, 443 Seiten Diagramme |
| ISBN: | 9780198805014 |
Internformat
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Datensatz im Suchindex
| _version_ | 1804179343749939200 |
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| any_adam_object | |
| author | Henriksen, Niels E. Hansen, Flemming Y. |
| author_GND | (DE-588)1157358128 (DE-588)1172758654 |
| author_facet | Henriksen, Niels E. Hansen, Flemming Y. |
| author_role | aut aut |
| author_sort | Henriksen, Niels E. |
| author_variant | n e h ne neh f y h fy fyh |
| building | Verbundindex |
| bvnumber | BV045448359 |
| classification_rvk | VE 5800 |
| classification_tum | CHE 150f CHE 163f |
| ctrlnum | (ELiSA)ELiSA-9780198805014 (OCoLC)1085388037 (DE-599)HBZHT019893372 |
| discipline | Chemie / Pharmazie Physik Chemie |
| edition | Second edition |
| format | Book |
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| id | DE-604.BV045448359 |
| illustrated | Not Illustrated |
| indexdate | 2024-07-10T08:18:22Z |
| institution | BVB |
| isbn | 9780198805014 |
| language | English |
| oai_aleph_id | oai:aleph.bib-bvb.de:BVB01-030833786 |
| oclc_num | 1085388037 |
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| physical | xiii, 443 Seiten Diagramme |
| publishDate | 2019 |
| publishDateSearch | 2019 |
| publishDateSort | 2019 |
| publisher | Oxford University Press |
| record_format | marc |
| series2 | Oxford graduate texts |
| spelling | Henriksen, Niels E. Verfasser (DE-588)1157358128 aut Theories of molecular reaction dynamics the microscopic foundation of chemical kinetics Niels Engholm Henriksen and Flemming Yssing Hansen Second edition Oxford Oxford University Press 2019 xiii, 443 Seiten Diagramme txt rdacontent n rdamedia nc rdacarrier Oxford graduate texts This book deals with a central topic at the interface of chemistry and physicsthe understanding of how the transformation of matter takes place at the atomic level. Building on the laws of physics, the book focuses on the theoretical framework for predicting the outcome of chemical reactions. The style is highly systematic with attention to basic concepts and clarity of presentation. The emphasis is on concepts and insights obtained via analytical theories ratherthan computational and numerical aspects.Molecular reaction dynamics is about the detailed atomic-level description of chemical reactions. Based on quantum mechanics and statistical mechanics, the dynamics of uni- and bi-molecular elementary reactions are described. The book features a comprehensive presentation of transition-state theory which plays an important role in practice, and a detailed discussion of basic theories of reaction dynamics in condensed phases. Examples and end-of-chapter problems are included in order toillustrate the theory and its connection to chemical problems.The second edition includes updated descriptions of adiabatic and non-adiabatic electron-nuclear dynamics, an expanded discussion of classical two-body models of chemical reactions, including the Langevin model, additional material on quantum tunnelling and its implementation in Transition-State Theory, and a more thorough description of the Born and Onsager models for solvation. Reaktionskinetik (DE-588)4048655-2 gnd rswk-swf Theoretische Chemie (DE-588)4185098-1 gnd rswk-swf Reaktionsdynamik (DE-588)4301792-7 gnd rswk-swf Reaktionsdynamik (DE-588)4301792-7 s Reaktionskinetik (DE-588)4048655-2 s Theoretische Chemie (DE-588)4185098-1 s 1\p DE-604 DE-604 Hansen, Flemming Y. Verfasser (DE-588)1172758654 aut 1\p cgwrk 20201028 DE-101 https://d-nb.info/provenance/plan#cgwrk |
| spellingShingle | Henriksen, Niels E. Hansen, Flemming Y. Theories of molecular reaction dynamics the microscopic foundation of chemical kinetics Reaktionskinetik (DE-588)4048655-2 gnd Theoretische Chemie (DE-588)4185098-1 gnd Reaktionsdynamik (DE-588)4301792-7 gnd |
| subject_GND | (DE-588)4048655-2 (DE-588)4185098-1 (DE-588)4301792-7 |
| title | Theories of molecular reaction dynamics the microscopic foundation of chemical kinetics |
| title_auth | Theories of molecular reaction dynamics the microscopic foundation of chemical kinetics |
| title_exact_search | Theories of molecular reaction dynamics the microscopic foundation of chemical kinetics |
| title_full | Theories of molecular reaction dynamics the microscopic foundation of chemical kinetics Niels Engholm Henriksen and Flemming Yssing Hansen |
| title_fullStr | Theories of molecular reaction dynamics the microscopic foundation of chemical kinetics Niels Engholm Henriksen and Flemming Yssing Hansen |
| title_full_unstemmed | Theories of molecular reaction dynamics the microscopic foundation of chemical kinetics Niels Engholm Henriksen and Flemming Yssing Hansen |
| title_short | Theories of molecular reaction dynamics |
| title_sort | theories of molecular reaction dynamics the microscopic foundation of chemical kinetics |
| title_sub | the microscopic foundation of chemical kinetics |
| topic | Reaktionskinetik (DE-588)4048655-2 gnd Theoretische Chemie (DE-588)4185098-1 gnd Reaktionsdynamik (DE-588)4301792-7 gnd |
| topic_facet | Reaktionskinetik Theoretische Chemie Reaktionsdynamik |
| work_keys_str_mv | AT henriksennielse theoriesofmolecularreactiondynamicsthemicroscopicfoundationofchemicalkinetics AT hansenflemmingy theoriesofmolecularreactiondynamicsthemicroscopicfoundationofchemicalkinetics |