Computational Lab

Our computer lab consists of 16 2.4 GHz Pentium IV computers. During the Fall and Winter semesters, most of them are set to run under Windows and are used for instructional purposes. Hyperchem is used for electronic structure and molecular dynamics calculations. During the summer, most of are running as a Linux cluster for research purposes. In this configuration, they currently have Gaussian03, Gamess, MOPAC, CHARMM, and AMBER running on them. The electronic structure programs have the user-friendly WebMO interface available.

Page last modified May 11, 2011