Introduction to Computational Quantum Chemistry
Semester:
Fall
Year:
2022
| Title | Time | Location | Syllabus | Instructor |
|---|---|---|---|---|
| Introduction to Computational Quantum Chemistry - One section |
Tuesday, Thursday 9:30am - 10:50am
|
 chem_580_1_gordon_f22.pdf |
(3-0) Cr. 3. Alt. F., offered even-numbered years. Prereq: CHEM 324
Basic 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.