CHEM 565
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Introduction to Quantum Chemistry
Chemistry and BiochemistryCollege of Physical and Mathematical Sciences
Course Description
Introduction to physical and mathematical aspects of quantum theory, emphasizing application of the Schrodinger wave equation to chemical systems.
When Taught
Winter
Min
3
Fixed/Max
3
Fixed
3
Fixed
0
Prerequisite
Fulfill ANY of the following requirements:
Complete ALL of the following Courses:
- 01040-007
OR
Complete ALL of the following Courses:
- 11826-000
Title
Outcome 1
Learning Outcome
Write and solve the Schrödinger equation in 1, 2 or 3 dimensions for 1, 2, or N particles for typical model problems and describe the meaning and significance of the solutions.
Title
Outcome 2
Learning Outcome
Interpret the wavefunctions in #1 by calculating probability in a region, expectation values and matrix elements of Hermitian operators corresponding to physical observables.
Title
Outcome 3
Learning Outcome
Use as necessary to solve problems: commutators of operators, basis set expansions, perturbation theory (degenerate and nondegenerate) and the variational principle.
Title
Outcome 4
Learning Outcome
Describe how the Hartree-Fock SCF method works and use Slater determinants of spin and spatial eigenfunctions to build anti-symmetric atomic wavefunctions
