Introducing students to research in computational kinetics

CHED 481

Keith T. Kuwata, kuwata@macalester.edu, Chemistry Department, Macalester College, 1600 Grand Avenue, Saint Paul, MN 55105-1899
My research program in computational kinetics makes use of both quantum chemistry and statistical rate theory to predict the mechanisms of chemical reactions in the atmosphere, and to model other systems of interest to my experimental collaborators. Most of my research students begin working in my laboratory the summer after their sophomore year, before they have taken the courses in physical chemistry that teach the theory underlying the methodology they are using. I will discuss how I have tried to choose and shape projects that draw on the chemical concepts and skills the rising juniors have already mastered. I will also discuss how my department's lower division curriculum increasingly gives students the opportunity to develop an intuitive understanding of quantum and statistical mechanics. This curricular renewal may have the (unintended) effect of better preparing students to do research in my laboratory.