-------------------------------------------------------------------- SEMINAR OF THE DYNAMICAL SYSTEMS GROUP Institute for Computational Sciences and Informatics -------------------------------------------------------------------- PREDICTING NEW MATERIALS L. L. Boyer Complex Systems Branch, Naval Research Laboratory The ultimate goal of computational condensed matter physics is is thought by many to be the prediction of new and useful materials. This requires, first of all, a reliable method for computing the stability of an arbitrary collection of atomic nuclei and electrons from first principles, that is, without resorting to experimental input other than universal constants. The method should also be able to predict the properties of a hypothetical material in order to know if an experimental effort to make samples is worthwhile. Some important advances toward achieving this goal will be discussed and illustrated with results which focus primarily on ferroelectric materials. Monday , 31 October 1994 5:30 pm Room 206, Science & Tech. I -------------------------------------------------------------------