Mar 28, 2024  
2014-2015 Catalog 
    
2014-2015 Catalog [ARCHIVED CATALOG]

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CHEM 225: Molecular Electronic Structure


[3.0 units]

Modern theoretical methods, algorithms, and computational tools for understanding the energetics and properties of molecules. This includes molecular mechanics, semi-empirical methods, but with a focus on ab initio based approaches. Electronic structure methods such as Hartree-Fock, density functional theory, couples-cluster, and configuration interaction will be introduced.

Prerequisite: CHEM 212  or consent of instructor.


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