CHEM 555 Applied Quantum Chemistry
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The hydrogen molecule: valence bond theory, the nature of the chemical bond; Hartree-Fock theory for molecules, basis sets, Koopmans' theorem, population analysis; electron correlation, density functional theory, perturbation theory, configuration interaction, multireference methods, applications.
Credit units: 3 ECTS Credit units: 5.
Autumn Semester (Fahri Alkan)
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