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Theoretical Chemistry by Jack Simons

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Theoretical Chemistry by Jack Simons

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.

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Advanced Theoretical Chemistry by Jack Simons

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.

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Lecture notes on theoretical chemistry

Lecture notes on theoretical chemistry

This lecture note explains the following topics: Specific Gravity, Chemical Nomenclature And Notation, Atoms Atomic Mass Valence, Chemical Formula, Structure Of Molecules, Chemical Equations And Calculations, Volume And Weight Relations Op Gases, The Periodic Law.

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Lecture Notes and Instructional Material in Theoretical Chemistry

Lecture Notes and Instructional Material in Theoretical Chemistry

This lecture note explains a number of chapters on advanced topics in various aspects of modern theoretical chemistry. Topics covered includes: approximation methods, atomic and molecular electronic structure, molecular spectroscopy, collision theory and chemical kinetics.

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Theoretical Chemistry I Quantum Mechanics (PDF 166p)

Theoretical Chemistry I Quantum Mechanics (PDF 166p)

This note explains the following topics: Wave Mechanics, Fundamental Concepts of Quantum Mechanics, Quantum Dynamics, Angular Momentum, Approximation Methods, Symmetry in Quantum Mechanics, Theory of chemical bonding, Scattering Theory and Relativistic Quantum Mechanics.

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