Chemistry 245: Computational Chemistry
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August 30, 2011
Introduction to
Computational Chemistry
September 6, 2011
September 13, 2011
Molecular Dynamics
Simulations
September 27, 2011
Hartree-Fock Theory
and Semi-Empirical Methods
October 4, 2011
Hartree-Fock Theory
and Basis Sets
October 11, 2011
October 18, 2011
November 1, 2011
November 8, 2011
Solvation and
Solvation Models
November 15, 2011
Applications of
Solvation Calculations
November 22, 2011
NMR & UV-Vis Spectroscopy; Open-Shell Molecules
November 29, 2011
Mixed Quantum
Mechanics/Molecular Mechanics Methods