Quantum chemistry
Author(s)
Bibliographic Information
Quantum chemistry
University Science Books, c2008
2nd ed
Available at 21 libraries
  Aomori
  Iwate
  Miyagi
  Akita
  Yamagata
  Fukushima
  Ibaraki
  Tochigi
  Gunma
  Saitama
  Chiba
  Tokyo
  Kanagawa
  Niigata
  Toyama
  Ishikawa
  Fukui
  Yamanashi
  Nagano
  Gifu
  Shizuoka
  Aichi
  Mie
  Shiga
  Kyoto
  Osaka
  Hyogo
  Nara
  Wakayama
  Tottori
  Shimane
  Okayama
  Hiroshima
  Yamaguchi
  Tokushima
  Kagawa
  Ehime
  Kochi
  Fukuoka
  Saga
  Nagasaki
  Kumamoto
  Oita
  Miyazaki
  Kagoshima
  Okinawa
  Korea
  China
  Thailand
  United Kingdom
  Germany
  Switzerland
  France
  Belgium
  Netherlands
  Sweden
  Norway
  United States of America
Note
Includes index
Description and Table of Contents
Description
The biggest change in the years since the first edition is the proliferation of computational chemistry programs that calculate molecular properties. McQuarrie presents step-by-step SCF calculations of a helium atom and a hydrogen molecule, in addition to including the Hartree-Fock method and post-Hartree-Fock methods.
Table of Contents
The Dawn of Quantum Theory.- The Classical Wave Equation.- The Schroedinger Equation and a Particle in a Box.- The Postulates and General Principles of Quantum Mechanics.- The Harmonic Oscillator and Vibrational Spectroscopy.- The Rigid Rotator and Rotational Spectroscopy.- The Hydrogen Atom.- Approximation Methods.- Many-Electron Atoms.- The Chemical Bond: One-and-Two-Electron Molecules.- Qualitative Theory of Chemical Bonding.- Appendices.- Solutions of Problems.- Index.
by "Nielsen BookData"