Advances in Quantum Chemistry: A Tribute Volume in Honour of Professor Osvaldo Goscinski - Advances in Quantum Chemistry

Marc Notes: Includes bibliographical references and index.; Formerly CIP.; Uk. Table of Contents: Selected Chapter Headings. Development of Chiral Catalysts for Stereoselective Synthesis by Deprotonations Experimentation in Interplay with Computational Chemistry. Proton Insertion in Polycrystalline WO3 Studied with Electron Spectroscopy and Semiempirical Calculations. Is There a Favorite Isomer for Hydrogen-Bonded Methanol in Water? Validation of the Applicability of Force Fields to Reproduce Ab Initio Noncovalent Interactions Involving Aromatic Groups in Proteins. Are Jordan Blocks Necessary for the Interpretation of Dynamical Processes in Nature? Antisymmetrized Geminal Power Coherent States. Current Methods for Coulomb Few-Body Problems. Electric Field Gradient Effects on Magnetic Susceptibility. Approximate Inclusion of the T3 and R3 Operators in the Equation-of-Motion Coupled Cluster Method. Calculation of Cross Sections in Electron-Nuclear Dynamics. Generalized Electronic Diabatic Ansatz: A Post Born-Oppenheimer Approach to Electronuclear Dynamics in External Fields. The Generator Coordinate Method for Atomic and Molecular Systems: Revision and Further Developments. Hybrid Quantum/Classical Dynamics Using Bohmian Trajectories. Conjugated Polymers in External DC Fields. Atoms, Molecules, Crystals and Nanotubes in Laser Fields: From Dynamical Symmetry to Selective High-Order Harmonic Generation of Soft X-Rays."

Contributor Bio:  Brandas, Erkki Uppsala University, Sweden