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Theoretical Chemistry by Jack Simons
This page covers the following topics related to Theoretical Chemistry : The Roles of Theory in Chemistry, The Laboratory-Theory Interface: What do Experiments Measure?, What is Present Day Theoretical Chemistry About, chemical kinetics, Oxidation numbers and electronegativities, Lewis acid-base concepts, Woodward- Hoffmann rules spectroscopy, Diffusion of gases in a polymer, Solvation of anions, Classical Newtonian Dynamics, Quantum Dynamics, Large Biomolecules and Polymers, Mixed Classical and Quantum Dynamics, The Car-Parrinello Method, etc.
Author(s): Jack Simons, University of Utah
NA Pages 
Advanced Theoretical Chemistry by Jack Simons
This page covers the following topics related to Advanced Theoretical Chemistry : The Basics of Quantum Mechanics, Model Problems That Form Important Starting Points, Characteristics of Energy Surfaces, Some Important Tools of Theory, An Overview of Theoretical Chemistry, Electronic Structure, Statistical Mechanics, Chemical dynamics.
Author(s): Jack Simons, University of Utah
NA Pages
Theoretical Chemistry by Jack Simons
This page covers the following topics related to Theoretical Chemistry : The Roles of Theory in Chemistry, The Laboratory-Theory Interface: What do Experiments Measure?, What is Present Day Theoretical Chemistry About, chemical kinetics, Oxidation numbers and electronegativities, Lewis acid-base concepts, Woodward- Hoffmann rules spectroscopy, Diffusion of gases in a polymer, Solvation of anions, Classical Newtonian Dynamics, Quantum Dynamics, Large Biomolecules and Polymers, Mixed Classical and Quantum Dynamics, The Car-Parrinello Method, etc.
Author(s): Jack Simons, University of Utah
NA Pages