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CHM 425 - Computational Chemistry |
This course is a hands-on computer laboratory course that covers the practical aspects of computational chemistry as applied in chemical structure and chemical dynamics calculations. Methods cover molecular mechanics, semi-empirical, ab-initio, molecular dynamics, and statistical mechanics. Calculations range from optimizations (ground, excited, and transition state) and conformational searching to structure-property relationships.
Prerequisite: Junior standing and above
2.000 Credit hours 0.000 Lecture hours 4.000 Lab hours Levels: Undergraduate Schedule Types: Lab, Tutorial Natural Sciences Department |