2013 AIChE Annual Meeting
Session: First-Prin?ciples Simulation?s of Condensed Phases
Contributions on all aspects of using first-principles simulation approaches (e.g., ab initio molecular dynamics, lattice dynamics, first principles Monte Carlo) to computing properties of condensed phases.
Chair
Lo, C., Washington University in St. Louis
Co-Chair
Deskins, N. A., Worcester Polytechnic Institute