Georgia Tech School of Chemistry and Biochemsitry Web Page, general information, faculty profiles, current events, center information, student information, graduate application, resources ...
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EAS ...
www.eas.gatech.edu/eas.html
Our goal is to apply the principles of quantum mechanics and electronic structure theory to address problems in physical, organic, inorganic, and biological chemistry. High performance computers are used to solve the complex equations describing the system of interest, yielding predictions of structures, bonding, energetics, reactivity, and other physical properties ...
vergil.chemistry.gatech.edu
The Center for Computational Molecular Science and Technology (CCMST) applies state of the art simulation techniques to a wide variety of molecular problems using an IBM SP supercomputer.