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  • © 1995

Quantum Mechanical Electronic Structure Calculations with Chemical Accuracy

Part of the book series: Understanding Chemical Reactivity (UCRE, volume 13)

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Table of contents (8 chapters)

  1. Front Matter

    Pages i-v
  2. Exact Quantum Chemistry by Monte Carlo Methods

    • James B. Anderson
    Pages 1-45
  3. Achieving Chemical Accuracy with Coupled-Cluster Theory

    • Timothy J. Lee, Gustavo E. Scuseria
    Pages 47-108
  4. Calculation of Accurate Bond Energies, Electron Affinities, and Ionization Energies

    • Larry A. Curtiss, Krishnan Raghavachari
    Pages 139-171
  5. Accurate Theoretical Studies of Small Elemental Clusters

    • Krishnan Raghavachari, Larry A. Curtiss
    Pages 173-207
  6. Electronic spectroscopy of diatomic molecules

    • Harry Partridge, Stephen R. Langhoff, Charles W. Bauschlicher Jr.
    Pages 209-260
  7. Theoretical Studies of the Electronic Spectra of Organic Molecules

    • Björn O. Roos, Markus Fülscher, Per-Ã…ke Malmqvist, Manuela Merchán, Luis Serrano-Andrés
    Pages 357-438
  8. Back Matter

    Pages 439-449

Editors and Affiliations

  • NASA Ames Research Center, Moffett Field, USA

    Stephen R. Langhoff

Bibliographic Information

Buy it now

Buying options

eBook USD 99.00
Price excludes VAT (USA)
  • Available as PDF
  • Read on any device
  • Instant download
  • Own it forever
Softcover Book USD 129.99
Price excludes VAT (USA)
  • Compact, lightweight edition
  • Dispatched in 3 to 5 business days
  • Free shipping worldwide - see info

Tax calculation will be finalised at checkout

Other ways to access