First-Principles Simulation of Condensed Phases

Wednesday, October 19, 2011: 8:30 AM
Conrad B (Hilton Minneapolis)

Description:
We invite papers concerning all types of first-principles simulations in bulk-phase systems. These might include (but are not limited to) density functional theory studies of material properties, phase equilibria, and chemical reactions in solution or at interfaces.


Sponsor:
Computational Molecular Science and Engineering Forum


Chair:
Cynthia Lo
Email: clo@wustl.edu

Co-Chair:
Lev Gelb
Email: lev.gelb@utdallas.edu