Transitions in molecular systems:
Gespeichert in:
| 1. Verfasser: | |
|---|---|
| Format: | Buch |
| Sprache: | English |
| Veröffentlicht: |
Weinheim
Wiley-VCH
2010
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| Schlagworte: | |
| Online-Zugang: | Inhaltstext Inhaltsverzeichnis |
| Beschreibung: | X, 331 S. Ill. |
| ISBN: | 9783527410132 |
Internformat
MARC
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Datensatz im Suchindex
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CONTENTS PREFACE IX 1 INTRODUCTION 1 1.1 THE ADIABATIC DESCRIPTION OF
MOLECULES 1 1.1.1 PRELIMINARIES 2 1.1.2 THE BORN-OPPENHEIMER
APPROXIMATION 3 1.1.3 THE CRUDE BORN-OPPENHEIMER BASIS SET 6 1.1.4
CORRECTION OF THE CRUDE ADIABATIC APPROXIMATION 7 1.2 NORMAL COORDINATES
AND DUSCHINSKY EFFECT 9 1.3 THE VIBRATIONAL WAVEFUNCTIONS 13 1.4 THE
DIABATIC ELECTRONIC BASIS FOR MOLECULAR SYSTEMS 14 1.4.1 PRELIMINARIES
14 1.4.2 CONICAL INTERSECTION BETWEEN THE STATES B 2 B 2 ! 2 AE ANDAE 2
AI/ 2 A'OFH 2 O + 16 1.4.3 THE LINEAR MODEL FOR CONICAL INTERSECTION 18
2 FORMAL DECAY THEORY OF COUPLED UNSTABLE STATES 21 2.1 THE TIME
EVOLUTION OF AN EXCITED STATE 21 2.1.1 SOME REMARKS ABOUT THE DECAY OF A
DISCRETE MOLECULAR METASTABLE STATE 26 2.2 THE CHOICE OF THE ZERO-ORDER
BASIS SET 27 3 DESCRIPTION OF RADIATIONLESS PROCESSES IN STATISTICAL
LARGE MOLECULES 31 BIBLIOGRAFISCHE INFORMATIONEN
HTTP://D-NB.INFO/999134396 DIGITALISIERT DURCH VI CONTENTS 3.3
DERIVATION OF THE PROMOTING MODE FACTORS K N (I) AND J N (T) 48 3.4
RADIATIONLESS DECAY RATES OF INITIALLY SELECTED VIBRONIC STATES IN
POLYATOMIC MOLECULES 52 4 CALCULATIONAL METHODS FOR INTRAMOLECULAR
DISTRIBUTIONS /* L 2 , AND I N 57 4.1 THE ONE-DIMENSIONAL DISTRIBUTION
II(0, N; A, B) 57 4.1.1 THE ADDITION THEOREM 60 4.2 THE DISTRIBUTIONS L
X {M, N; A, B) 63 4.2.1 DERIVATION OF H(M, N; A, B) 61 4.2.2 THE
ADDITION THEOREM FOR H(M, N; A, B) 65 4.2.3 THE RECURRENCE FORMULA 65
4.2.4 CASE B = 0 67 4.2.5 CASE B / 0 68 4.2.6 NUMERICAL RESULTS 69 4.3
CALCULATION OF THE MULTIDIMENSIONAL DISTRIBUTION 71 4.3.1 PRELIMINARY
CONSIDERATION 71 4.3.2 DERIVATION OF RECURRENCE EQUATIONS 75 4.3.
CONTENTS VII 6.4 RADIATIVE DECAY IN INTERNAL CONVERSION BY INTRODUCTION
OF DECAY RATES FOR {I|)]} 142 6.5 DEPHASING AND RELAXATION IN MOLECULAR
SYSTEMS 345 6.5.1 INTRODUCTION 145 6.5.2 INTERACTION OF A LARGE MOLECULE
WITH A LIGHT PULSE 146 6.5.3 FREE INDUCTION DECAY OF A LARGE MOLECULE
149 6.5.4 PHOTON ECHOES FROM LARGE MOLECULES 151 7 MISCELLANEOUS
APPLICATIONS 155 7.1 THE LINE SHAPE FUNCTION FOR RADIATIVE TRANSITIONS
355 7.1.1 DERIVATION 155 7.1.2 IMPLEMENTATION OF THEORY AND RESULTS 160
7.1.2.1 EXCITED-STATE GEOMETRY 369 7.2 ON THE MECHANISM OF
SINGLET-TRIPLET INTERACTION 171 7.2.1 PHOSPHORESCENCE IN AROMATIC
MOLECULES WITH NONBONDING ELECTRONS 171 7.2.2 RADIATIVE T X (MI*)- S O
TRANSITION 172 7.2.3 NONRADIATIVE TRIPLET-TO-GROUND STATE TRANSITION 178
7.2.3.1 THEORY AND APPLICATION 179 7.2.4 REMARKS ON THE INTERSYSTEM
CROSSING IN AROMATIC HYDROCARBONS 183 7.3 COMMENT ON THE TEMPERATURE
DEPENDENCE OF RADIATIONLESS TRANSITIO VIU CONTENTS 8.3 SOME NUMERICAL
RESULTS AND DISCUSSION 241 8.4 IMPLEMENTATION OF THEORY AND RESULTS 244
8.4.1 THE RESONANCE RAMAN PROCESS AND DUSCHINSKY MIXING EFFECT 244 8.4.2
TIME-DELAYED TWO-PHOTON PROCESSES: DUSCHINSKY MIXING EFFECTS 247 8.4.3
RESULTS 249 8.5 THE ONE-DIMENSIONAL FRANCK-CONDON FACTOR (N = 1) 255
APPENDICES 259 APPENDIX A: SOME IDENTITIES RELATED TO GREEN'S FUNCTION
261 A.I THE GREEN'S FUNCTION TECHNIQUE 263 A.2 EVALUATION OF THE
DIAGONAL MATRIX ELEMENT OF G SS 264 APPENDIX B: THE COEFFICIENTS OF THE
RECURRENCE EQUATION 267 APPENDIX C: THE COEFFICIENTS OF THE RECURRENCE
EQUATIONS 271 APPENDIX D: SOLUTION OF A CLASS OF INTEGRALS 273 APPENDIX
E: QUANTIZATION OF THE RADIATION FIELD 277 APPENDIX F: THE MOLECULAR
EIGENSTATES 281 APPENDIX G: THE EFFECTIVE HAMILTONIAN AND ITS PROPERTIES
285 APPENDIX H: THE MECHANISM OF NONRADIATIVE ENERGY TRANSFER 287 H.I
SINGLE-STEP RESONANCE ENERGY TRANSFER 287 H.2 PHONON-ASSISTED ENERGY
TRANSFER 289 APPENDI |
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| dewey-ones | 539 - Modern physics |
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| dewey-sort | 3539.6 |
| dewey-tens | 530 - Physics |
| discipline | Chemie / Pharmazie Physik |
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| language | English |
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| spelling | Kupka, Hans J. Verfasser (DE-588)141555173 aut Transitions in molecular systems Hans J. Kupka Weinheim Wiley-VCH 2010 X, 331 S. Ill. txt rdacontent n rdamedia nc rdacarrier Strahlungsloser Übergang (DE-588)4183542-6 gnd rswk-swf Molekülphysik (DE-588)4039979-5 gnd rswk-swf Elektronenübergang (DE-588)4290574-6 gnd rswk-swf Molekülphysik (DE-588)4039979-5 s Elektronenübergang (DE-588)4290574-6 s Strahlungsloser Übergang (DE-588)4183542-6 s DE-604 text/html http://deposit.dnb.de/cgi-bin/dokserv?id=3404682&prov=M&dok_var=1&dok_ext=htm Inhaltstext DNB Datenaustausch application/pdf http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=020441453&sequence=000001&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA Inhaltsverzeichnis |
| spellingShingle | Kupka, Hans J. Transitions in molecular systems Strahlungsloser Übergang (DE-588)4183542-6 gnd Molekülphysik (DE-588)4039979-5 gnd Elektronenübergang (DE-588)4290574-6 gnd |
| subject_GND | (DE-588)4183542-6 (DE-588)4039979-5 (DE-588)4290574-6 |
| title | Transitions in molecular systems |
| title_auth | Transitions in molecular systems |
| title_exact_search | Transitions in molecular systems |
| title_full | Transitions in molecular systems Hans J. Kupka |
| title_fullStr | Transitions in molecular systems Hans J. Kupka |
| title_full_unstemmed | Transitions in molecular systems Hans J. Kupka |
| title_short | Transitions in molecular systems |
| title_sort | transitions in molecular systems |
| topic | Strahlungsloser Übergang (DE-588)4183542-6 gnd Molekülphysik (DE-588)4039979-5 gnd Elektronenübergang (DE-588)4290574-6 gnd |
| topic_facet | Strahlungsloser Übergang Molekülphysik Elektronenübergang |
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