Introduction to Computational Quantum Chemistry

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Graduate Standing or Permission of InstructorBasic principles of quantum mechanics, schrodinger equation. Hartree-Fock/molecular orbital theory, introduction to group theory, introduction to modern methods of computational chemistry; applications include molecular structure, potential energy surfaces and their relation to chemical reactions; molecular spectroscopy, photochemistry, solvent effects and surface chemistry. Offered odd-numbered years. (Typically Offered: Fall)→CHEM 5800→unlocks 0 courses

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