Comprehensive Computational Chemistry

ISBN-13: 9780128219782 / Angielski

Russell J. Boyd; Manuel Yanez

Opis

Comprehensive Computational Chemistry, Four Volume Set consists of around 140 chapters covering the full spectrum of the field, including the fundamental basis of the theoretical methods used in a broad range of topics in chemistry, the development of algorithms and software packages, and a broad range of applications to topics in atmospheric chemistry, biochemistry, materials science and medicinal chemistry, and other areas in which computational chemistry is having an impact.

Spis treści

1. Advanced Electronic Structure Methods and Multireference Methods edited by Krishnan Raghavachari (Indiana University, IN, United States
2. The Valence Bond and Alternative Viewpoints edited by Sason Shaik (The Hebrew University of Jerusalem, Israel) & Philippe Hiberty (Université Paris-Saclay, France)
3. The Analysis of Chemical Bonding and the Interpretation of Wave Functions edited by Paul Popelier (University of Manchester, UK)
4. Clusters and Nanostructures edited by Eluvathingal D. Jemmis & R.S Swathi (Indian Institute of Science, India)
5. Relativistic Effects and the Chemistry of Heavy Elements edited by Kenneth Ruud (UiT The Arctic University of Norway, Norway)
6. Molecular Dynamics Simulations and Reaction Rates edited by Aatto Laaksonen and Francesca Mocci (Stockholm University, Sweden & Università di Cagliari, Italy)
7. Excited States and Photodynamic Simulations from Photobiology to Photomaterials edited by Leticia Gonzalez (Universität Wien, Austria)
8. Molecular Interactions and Catalysis edited by Heather Kulik (MIT, United States)