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CHY 706
Computational and Quantum Chemistry
Basic and advanced molecular modelling: molecular mechanics and dynamics; electronic structure calculations (model chemistries, energy calculations, geometry optimizations, prediction of chemical properties); theoretical methods (Hartree-Fock theory, electron correlation methods, density functional theory, excited state methods); calculation and prediction of molecular spectra.
Weekly Contact: Lecture: 3 hrs.
GPA Weight: 1.00
Course Count: 1.00
Billing Units: 1
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