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Molecular Electronic-Structure Theory

by Trygve Helgaker (University of Oslo, Norway); Poul Jorgensen (Aarhus University, Denmark); Jeppe Olsen (University of Aarhus, Denmark)

  • ISBN: 9780471967552
  • ISBN10: 0471967556

Molecular Electronic-Structure Theory

by Trygve Helgaker (University of Oslo, Norway); Poul Jorgensen (Aarhus University, Denmark); Jeppe Olsen (University of Aarhus, Denmark)

  • List Price: $831.95
  • Binding: Hardcover
  • Publisher: John Wiley & Sons
  • Publish date: 10/01/2000
  • ISBN: 9780471967552
  • ISBN10: 0471967556
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Description: Second Quantization. Spin in Second Quantization. Orbital Rotations. Exact and Approximate Wave Functions. The Standard Models. Atomic Basis Functions. Short-Range Interactions and Orbital Expansions. Gaussian Basis Sets. Molecular Integral Evaluation. Hartree-Fock Theory. Configuration-Interaction Theory. Multiconfigurational Self-Consistent Field Theory. Coupled-Cluster Theory. Perturbation Theory. Calibration of the Electronic-Structure Models. List of Acronyms. Index.
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