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Fundamentals of Quantum Chemistry Molecular Spectroscopy and Modern Electronic Structure Computations

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ISBN-10: 0306465965

ISBN-13: 9780306465963

Edition: 2001

Authors: Michael M�ller

List price: $159.99
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Book details

List price: $159.99
Copyright year: 2001
Publisher: Springer
Publication date: 6/30/2001
Binding: Hardcover
Pages: 265
Size: 6.75" wide x 10.25" long x 0.75" tall
Weight: 1.628
Language: English

Classical Mechanics
Newtonian Mechanics
Hamiltonian Mechanics
The Harmonic Oscillator
Fundamentals of Quantum Mechanics
The de Broglie Relationship
Accounting for Wave Character in Mechanical Systems
The Born Interpretation
Hermitian Operators
Operators and Expectation Values
The Heisenberg Uncertainty Principle
Particle in a Three-Dimensional Box and Degeneracy
Rotational Motion
Techniques of Approximation
Variation Theory
Time-Independent Non-Degenerate Perturbation Theory
Time-Independent Degenerate Perturbation Theory
Particles Encountering a Finite Potential Energy
Harmonic Oscillator
Tunneling, Transmission, and Reflection
Vibrational/Rotational Spectroscopy of Diatomic Molecules
Fundamentals of Spectroscopy
Rigid Rotor Harmonic Oscillator Approximation (RRHO)
Vibrational Anharmonicity
Centrifugal Distortion
Vibration-Rotation Coupling
Spectroscopic Constants from Vibrational Spectra
Time Dependence and Selection Rules
Vibrational and Rotational Spectroscopy of Polyatomic Molecules
Rotational Spectroscopy of Linear Polyatomic Molecules
Rotational Spectroscopy of Non-Linear Polyatomic Molecules
Infrared Spectroscopy of Polyatomic Molecules
Atomic Structure and Spectra
One-Electron Systems
The Helium Atom
Electron Spin
Complex Atoms
Spin-Orbit Interaction
Selection Rules and Atomic Spectra
Methods of Molecular Electronic Structure Computations
The Born-Oppenheimer Approximation
The H[subscript 2 superscript +] Molecule
Molecular Mechanics Methods
Ab Initio Methods
Semi-Empirical Methods
Density Functional Methods
Computational Strategies
Table of Physical Constants
Table of Energy Conversion Factors
Table of Common Operators