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Quantum chemistry

Author: John P Lowe; Kirk A Peterson
Publisher: Burlington, MA : Elsevier Academic Press, ©2006.
Edition/Format:   Print book : English : 3rd edView all editions and formats
Summary:
"Lowe and Peterson's Quantum Chemistry, Third Edition, assumes little mathematical or physical sophistication and emphasizes an understanding of techniques and results. It can serve as a primary text in quantum chemistry courses, and enables students and researchers to comprehend the current literature. Previous editions have been consistently praised for their appealing writing style and clear pedagogy. Lowe and  Read more...
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Material Type: Internet resource
Document Type: Book, Internet Resource
All Authors / Contributors: John P Lowe; Kirk A Peterson
ISBN: 012457551X 9780124575516
OCLC Number: 60798495
Description: xxii, 703 pages : illustrations ; 27 cm
Contents: Classical waves and the time-independent Schrodinger wave equation --
Quantum mechanics of some simple systems --
The one-dimensional harmonic oscillator --
The hydrogenlike ion, angular momentum, and the rigid rotor --
Many-electron atoms --
Postulates and theorems of quantum mechanics --
The variation method --
The simple Huckel method and applications --
Maxtrix formulation of the linear variation method --
The extended Huckel method --
The SCF-LCAO-MO method and extensions --
Time-independent Rayleigh-Schrodinger perturbation theory --
Group theory --
Qualitative molecular orbital theory --
Molecular orbital theory of periodic systems --
Appendix 1: Useful integrals --
Appendix 2: Determinants --
Appendix 3: Evaluation of the Coulomb repulsion integral over 1s AOs --
Appendix 4: Angular momentum rules --
Appendix 5: The Pairing theorem --
Appendix 6: Hückel molecular orbital energies, coefficients, electron densities, and bond orders for some simple molecules --
Appendix 7: Derivation of the Hartree-Fock equation --
Appendix 8: The virial theorem for atoms and diatomic molecules --
Appendix 9: Bra-Ket notation --
Appendix 10: Values of some useful constants and conversion factors --
Appendix 11: Group theoretical charts and tables --
Appendix 12: Hints for solving selected problems --
Appendix 13: Answers to problems.
Responsibility: John P. Lowe, Kirk A. Peterson.
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Abstract:

Emphasizing an understanding of the techniques and results of quantum chemistry, this book provides treatment of the simple systems basic to quantum chemistry. It includes numerous exercises to  Read more...

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"This new edition is based closely on the already outstanding second edition, with the addition of a co-author and appropriate updating, reworking, and elaboration of the material. The overall Read more...

 
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