Fundamentals of quantum chemistry
著者
書誌事項
Fundamentals of quantum chemistry
（Complementary science series）
Academic Press, c2004
2nd ed
- pbk. : acid-free paper
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注記
Rev. ed. of: Fundamentals of quantum mechanics. c1998
Includes bibliographical references and index
HTTP:URL=http://www.loc.gov/catdir/toc/els051/2004044070.html Information=Table of contents
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内容説明・目次
内容説明
Fundamentals of Quantum Chemistry is an introduction to the principles of quantum mechanics needed in physical chemistry. Mathematical tools are presented and developed as needed and only basic calculus, chemistry, and physics is assumed. Applications include atomic and molecular structure, spectroscopy, alpha decay, tunneling, and superconductivity. New edition includes sections on perturbation theory, orbital symmetry of diatomic molecules, the Huckel MO method and Woodward/Hoffman rules as well as a new chapter on SCF and Hartree-Fock methods.
目次
1. The Early Days
2. The Quantum Mechanical Way of Doing Things
3. Particles in Boxes
4. The Hydrogen Atom
5. More Complex Atoms
6. Vibrations and the Harmonic Oscillator
7. Molecular Rotation and Spectroscopy
8. Barrier Penetration
9. Diatomic Molecules
10. Symmetry
11. Huckel Molecular Orbital Methods
12. More Complete Molecular Orbital Methods
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