Molecular orbital theory of organic and inorganic chemistry. Applications of computational chemistry to chemical bonding, aromaticity, molecular spectra. Semi-empirical and ab initio electronic structure theory. Comparison of theoretical methods used to obtain molecular properties. Introduction to statistical thermodynamics. Prerequisite(s): CHEM 3101.Lectures and problems three hours a week.

CHEM 3102 [0.5 credit] Methods of Computational Chemistry

Molecular orbital theory of organic and inorganic chemistry. Applications of computational chemistry to chemical bonding, aromaticity, molecular spectra. Semi-empirical and ab initio electronic structure theory. Comparison of theoretical methods used to obtain molecular properties. Introduction to statistical thermodynamics. Prerequisite(s): CHEM 3101.Lectures and problems three hours a week.





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