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 A Brief Review of Elementary Quantum Chemistry
  • A Brief Review of Elementary Quantum Chemistry
  • Contents:
    The Motivation for Quantum Mechanics
    The Ultraviolet Catastrophe
    The Photoelectric Effect
    Quantization of Electronic Angular Momentum
    Wave-Particle Duality
    The Schr?dinger Equation
    The Time-Independent Schr?dinger Equation
    The Time-Dependent Schr?dinger Equation
    Mathematical Background
    Operators
    Operators and Quantum Mechanics
    Basic Properties of Operators
    Linear Operators
    Eigenfunctions and Eigenvalues
    Hermitian Operators
    Unitary Operators
    Commutators in Quantum Mechanics
    Linear Vector Spaces in Quantum Mechanics
    Postulates of Quantum Mechanics
    Some Analytically Soluble Problems
    The Particle in a Box
    The Harmonic Oscillator
    The Rigid Rotor
    The Atom
    Molecular Quantum Mechanics
    The Molecular Hamiltonian
    The Born-Oppenheimer Approximation
    Separation of the Nuclear Hamiltonian
    Solving the Electronic Eigenvalue Problem
    The Nature of Many-Electron Wavefunctions
    Matrix Mechanics
    Bibliography

    The book was originally created for internal use at CCQC (Center for Computational Quantum Chemistry at the University of Georgia).

    contact

    C. David Sherrill
    Center for Computational Quantum Chemistry
    University of Georgia
    USA

    Phone: 404-894-4037
    Fax: 404-894-7452
    E-mail: sherrill@chemistry.gatech.edu

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