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Molecular Electromagnetism: A Computational Chemistry Approach (Oxford Graduate Texts)

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Book Details:

  • Author: Stephan P. A. Sauer

  • Brand: Oxford University Press

  • Edition: 1st Edition

  • Binding: Hardcover

  • Number of Pages: 322

  • Release Date: 04-08-2011

  • Part Number: 9780199575398

  • EAN: 9780199575398

  • Languages: English

About the Book:

This textbook is designed for a one-semester course on the theory and calculation of molecular electromagnetic and spectroscopic properties. It is intended to provide a solid foundation for calculating electromagnetic and spectroscopic properties of molecules using modern quantum chemical software packages.

Key topics covered include:

  • The derivation of the molecular Hamiltonian in the presence of electromagnetic fields.

  • Time-independent and time-dependent perturbation theory, specifically in the form of response theory.

  • A detailed exploration of molecular properties and spectral parameters.

  • An introduction to modern computational chemistry methods.