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Mathematical chemistry /

Detalles Bibliográficos
Clasificación:Libro Electrónico
Otros Autores: Hong, W. I. (Wei Inu), 1945-
Formato: Electrónico eBook
Idioma:Inglés
Publicado: New York : Nova Science Publishers, Ã2010.
Colección:Chemistry research and applications series.
Temas:
Acceso en línea:Texto completo

MARC

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020 |a 9781616684402  |q (electronic bk.) 
020 |z 9781608768943  |q (hardcover) 
020 |z 1608768945  |q (hardcover) 
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049 |a UAMI 
245 0 0 |a Mathematical chemistry /  |c W.I. Hong, editor. 
260 |a New York :  |b Nova Science Publishers,  |c Ã2010. 
300 |a 1 online resource (xii, 613 pages) :  |b illustrations 
336 |a text  |b txt  |2 rdacontent 
337 |a computer  |b c  |2 rdamedia 
338 |a online resource  |b cr  |2 rdacarrier 
490 1 |a Chemistry research and applications 
504 |a Includes bibliographical references and index. 
588 0 |a Print version record. 
505 0 |a MATHEMATICAL CHEMISTRY; CONTENTS; PREFACE; EXACT TREATMENT OF FINITE RANKMODIFICATIONS OF FINITE-DIMENSIONALAND INFINITE-DIMENSIONAL QUANTUM SYSTEMS; Abstract; 1. Introduction; 2. Description of Finite-Dimensional Systems; 3. Internal and External Modifications of Finite-DimensionalSystems; 4. LRM Treatment of External Modificationsof Finite-Dimensional Systems; 4.1. Interlacing of Modified Eigenvalues s f with Parent Eigenvalues in; 4.2. Cardinal Solutions of the Combined System; 4.3. Singular Solutions of the Combined System; 4.4. Numerical Considerations. 
505 8 |a 4.5. Normalization of Modified Eigenstates4.6. Numerical Example; 5. Internal Modifications of Finite-Dimensional Systems; 5.1. Interlacing of Modified Eigenvalues s f with Eigenvalues in; 5.2. Cardinal Solutions of the Modified System; 5.3. Singular Solutions of the Modified System; 5.4. Case P = 0; 5.5. Case V = 0; 6. LRM Treatment of the Vibrational IsotopeEffect in the Harmonic Approximation; 6.1. Out-Of-Plane Vibrations of Planar Molecules; 6.2. Interlacing Rule for out-of-Plane Vibrations of Planar Molecules; 6.3. Single Isotopic Substitutions; 6.4. Inversion Relations. 
505 8 |a 6.5. Interlacing of Out-of-Plane Vibrational Frequencies of Thiopheneand Deuterated Thiophenes6.6. Out-of-Plane Vibrations of Ethylene Isotopomers; 6.7. Out-of-Plane Vibrations of Benzene Isotopomers; 6.8. Equality of LRM and DFT out-of-Plane Frequenciesof Benzene (H, D)-Isotopomers; 6.9. Comparison of LRM, Frequency Scaled DFT and Experimental out-of-Plane Frequencies of Benzene (H, D)-Isotopomers; 7. External Modification as a Special Case of InternalModification; 8. Infinite Dimensional Systems; 9. Description of an Infinite-Dimensional System. 
505 8 |a 10. External Modifications of Infinite-Dimensional Systems11. General Properties of The Solutionsto the Infinite-Dimensional Combined System; 11.1. Fractional Shift; 11.2. Description of the Open System that Interacts with an Infinite System; 12. Characteristic and Derived Operators; 12.1. Calculation of the Derived Operators; 13. Isolated Solutions of the Infinite-Dimensional CombinedSystem; 13.1. Resonant Points; 13.2. Probabilities Associated with Isolated Cardinal Eigenstates; 14. Embeded Solutions of the Combined System; 14.1. Embedded Cardinal Solutions. 
505 8 |a 14.2. Embedded Singular Solutions15. Completeness Relations; 16. One Dimensional Open Systems; 17. Examples; 17.1. Example E1; 17.2. Example E2; 17.3. Example E3: Interaction of a Single State with one-Dimensional Solid inThe Nearest-Neighbor Tight-Binding Approximation; 18. Time-Dependent Systems; 19. One Dimensional Open Systems -- Time Dependent Case; 19.1. Decay of a Local State in the Weak Coupling Limit; 19.2. Transitions of the State K to The Eigenstates of the System A; 19.3. Transition of the Local State to The System A in the Weak CouplingLimit; 19.4. Example E4; 19.5. Example E5. 
590 |a eBooks on EBSCOhost  |b EBSCO eBook Subscription Academic Collection - Worldwide 
650 0 |a Chemistry  |x Mathematics. 
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650 7 |a Chemistry  |x Mathematics  |2 fast 
700 1 |a Hong, W. I.  |q (Wei Inu),  |d 1945- 
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830 0 |a Chemistry research and applications series. 
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