New Trends in Quantum Systems in Chemistry and Physics

New Trends in Quantum Systems in Chemistry and Physics

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This is one of two volumes which together comprise about 40 papers coming from the most outstanding contributions to the fourth European Quantum Systems in Chemistry and Physics workshop held in Marly, France, in 1999. These books cover a broad spectrum of scientific research work from quantum-mechanical many-body methods to important applications and computational developments, and from atoms and molecules to condensed matter. The first volume is subtitled "Basic Problems and Model Systems", which includes the following topics: density matrices and density functionals, electron correlation effects, relativistic formulations and effects, valence theory and nuclear motion. The second volume is subtitled "Advanced Problems and Complex Systems" and covers the following topics: response theory, reactive collisions and chemical reactions and condensed matter.
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Product details

  • Hardback | 324 pages
  • 156 x 234mm
  • Dordrecht, Netherlands, United States
  • English
  • 0792367103
  • 9780792367109

Table of contents

Part VI Response theory - properties and spectra: on gauge invariance and molecular electrodynamics, R.G. Woolley; quantum mechanics of electro-nuclear systems - towards a theory of chemical reactions, O. Tapia; theoretical study of regularities in atomic and molecular spectral properties, I. Martin, et al; excited states of hydrogen peroxide - an overview, P.K. Mukherjee, et al.; on electron dynamics in violent cluster excitations, P.G. Reinhard, E. Suraud; relativistic effects in non-linear atom-laser interactions at ultrahigh intensities, V. Veniard, et al. Part VII Reactive collisions and chemical reactions: semiclassical close-coupling description of electron transfer in multi-charged ion-atom collisions, J. Caillat, et al.; single and double electron capture in boron collision systems, M.C. Bacchus-Montabonel, P. Honvault. Theoretical study of the interaction of carbon dioxide with Sc, Ti, Ni, and Cu-atoms, F. Mele, et al. Part VIII Condensed matter: recurrent variational approach applied to the electronic structure of conjugated polymers, S. Pleutin, et al.; effects of solvation for (R,R)-tartaric acid amides, M. Hoffmann, J. Rychlewski; interpretation of vibrational spectra in electrochemical environments from first-principle calculations - computational strategies, M. Garcia-Hernandez, et al.; excited states in metal oxides by configuration interaction and multireference perturbation theory, C. Sousa, et al.;(Part contents).
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