Selected topics of the theory of chemical elementary processes:
Saved in:
| Main Authors: | , |
|---|---|
| Format: | Book |
| Language: | English |
| Published: |
Berlin u.a.
Springer
1978
|
| Series: | Lecture notes in chemistry
8 |
| Subjects: | |
| Online Access: | Inhaltsverzeichnis |
| Item Description: | Rückent.: Nikitin: Chemical elementary processes |
| Physical Description: | IX, 175 S. |
| ISBN: | 3540087680 0387087680 |
Staff View
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| 245 | 1 | 0 | |a Selected topics of the theory of chemical elementary processes |c E. E. Nikitin ; L. Zülicke |
| 264 | 1 | |a Berlin u.a. |b Springer |c 1978 | |
| 300 | |a IX, 175 S. | ||
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| 500 | |a Rückent.: Nikitin: Chemical elementary processes | ||
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Record in the Search Index
| _version_ | 1804116709310726144 |
|---|---|
| adam_text | Lecture Notes in
Chemistry
Edited by G Berthier, MJS Dewar, H Fischer
K Fukui, H Hartmann, H H Jaffe, J Jortner
W Kutzelnigg, K Ruedenberg, E Scrocco, W Zeil
E E Nikitin
L Zulicke
Selected Topics of the
Theory of
Chemical Elementary Processes
w
Springer-Verlag
Berlin Heidelberg New York 1978
Contents
Preface
Introduction 1
Basic Concepts and Phenomenological Description 6
Separation of the Center-of-Mass Motion 8
Separation of Electronic and Nuclear Motions
Interaction Potentials (Potential-Energy
Surfaces) 11
Heuristic Considerations 11
Born-Oppenheimer Separation Adiabatic
Approximat ion 16
Present State of Potential-Energy-Surface
Calculations 23
Scattering Channels 26
Classification of;Elementary Processes
Microscopic Mechanism 27
Dynamics of Atomic and Molecular Collisions:
Electronically Adiabatic Processes 32
Classical Approach 33
Some Arguments for the Reliability of the
Classical Approach 33
Atom-Atom Collisions Elastic Scattering 34
Quasiclassical Treatment of Elementary
Processes in Triatomic Systems: Inelastic
and Reactive Scattering 44
IV
314 Examples of Results of Trajectory Calculations 59
3 2 Elements of Quantum-Mechanical Methods 64
321 Correspondence of Classical and Quantum-
Mechanical Theories 64
322 Time-Dependent Scattering Theory 71
323 Stationary Scattering Theory 77
3231 One-Dimensional Scattering 78
3232 Three-Dimensional Elastic Scattering 83
3233 Rearrangement Scattering (Reactions) 85
324 Examples of Quantum-Mechanical Calculations
of Reactive Elementary Processes 89
4 Classical-Limit and SemLclassical Approaches
to the Calculation of Molecular Collisional
Transition Probabilities 95
4 1 Classical S-Matrix Method 99
4 2 The Semiclassical Approach 109
4 3 Calculation of Transition Probabilities
Using the Correspondence Principle 116
5 Theory of Non-Adiabatic Transitions in
Atomic and Molecular Collision Processes 123
5 1 Crossing and Pseudo-Crossing of Potential-
Energy Surfaces 125
5 2 Non-Adiabatic Coupling and Selection Rules 129
I
5 3 The Two-State Problem in Adiabatic and
Diabatic Representations 135
5 4 The Landau-Zener Model 145
541 Non-Adiabatic Transitions between Electronic
Terms of Different Symmstry -145
V
542 Non-Adiabatic Transitions! between Electronic
Terms of the Same Symmetry 150
543 The Surface-Hopping Trajectory Method 155
Appendix
Transformation of the Hamiltonian to Center-
of-Mass and Relative Coordinates 161
Literature 164
Subject Index 171
|
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| id | DE-604.BV002252972 |
| illustrated | Not Illustrated |
| indexdate | 2024-07-09T15:42:49Z |
| institution | BVB |
| isbn | 3540087680 0387087680 |
| language | English |
| oai_aleph_id | oai:aleph.bib-bvb.de:BVB01-001480452 |
| oclc_num | 3915469 |
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| owner_facet | DE-355 DE-BY-UBR DE-29T DE-83 DE-188 |
| physical | IX, 175 S. |
| psigel | TUB-nveb |
| publishDate | 1978 |
| publishDateSearch | 1978 |
| publishDateSort | 1978 |
| publisher | Springer |
| record_format | marc |
| series | Lecture notes in chemistry |
| series2 | Lecture notes in chemistry |
| spelling | Nikitin, Evgenij E. Verfasser aut Selected topics of the theory of chemical elementary processes E. E. Nikitin ; L. Zülicke Berlin u.a. Springer 1978 IX, 175 S. txt rdacontent n rdamedia nc rdacarrier Lecture notes in chemistry 8 Rückent.: Nikitin: Chemical elementary processes Chemical reaction, Conditions and laws of Elementarreaktion (DE-588)4070762-3 gnd rswk-swf Elementarreaktion (DE-588)4070762-3 s DE-604 Zülicke, Lutz 1936- Verfasser (DE-588)106083872 aut Lecture notes in chemistry 8 (DE-604)BV000000216 8 HEBIS Datenaustausch application/pdf http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=001480452&sequence=000002&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA Inhaltsverzeichnis |
| spellingShingle | Nikitin, Evgenij E. Zülicke, Lutz 1936- Selected topics of the theory of chemical elementary processes Lecture notes in chemistry Chemical reaction, Conditions and laws of Elementarreaktion (DE-588)4070762-3 gnd |
| subject_GND | (DE-588)4070762-3 |
| title | Selected topics of the theory of chemical elementary processes |
| title_auth | Selected topics of the theory of chemical elementary processes |
| title_exact_search | Selected topics of the theory of chemical elementary processes |
| title_full | Selected topics of the theory of chemical elementary processes E. E. Nikitin ; L. Zülicke |
| title_fullStr | Selected topics of the theory of chemical elementary processes E. E. Nikitin ; L. Zülicke |
| title_full_unstemmed | Selected topics of the theory of chemical elementary processes E. E. Nikitin ; L. Zülicke |
| title_short | Selected topics of the theory of chemical elementary processes |
| title_sort | selected topics of the theory of chemical elementary processes |
| topic | Chemical reaction, Conditions and laws of Elementarreaktion (DE-588)4070762-3 gnd |
| topic_facet | Chemical reaction, Conditions and laws of Elementarreaktion |
| url | http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=001480452&sequence=000002&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA |
| volume_link | (DE-604)BV000000216 |
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