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- Anatole von Lilienfeld - Predictive Multiscale Materials Characterization and Rational Design of Reactive Compounds
- Andrew Taube - Quantum Chemistry, Coupled Cluster Method MD
Staff
- John Aidun - Manager, Multiscale Material Methods, Shock Wave Physics
- John Carpenter - Equation of State Modeling, Statistical Physics
- Paul Crozier - Molecular Dynamics Methods, Biological Macromolecules
- Harold Hjalmarson - Semiconductor Physics, Radiation Effects, Multiscale Material Methods
- David Littlewood - Peridynamics, Extended Finite-Element Method, High-Performance Computing
- Rudolph Magyar - Time-dependent DFT, Condensed Matter Theory
- Ann Mattsson - Equation of State Modeling, Advanced DFT Functionals, Condensed Matter Theory
- Richard Muller - Quantum Chemistry, Catalysis, Enzyme Function, Fuel Cells, Multiscale Material Methods
- Joshua Robbins - Finite element methods development for grain-scale simulation of heterogeneous materials, Constitutive modeling of ferroelectrics, Shock wave physics
- Peter Schultz - Quantum Electronic Structure Methods: SeqQuest, Quantum Chemistry, Multiscale Material Methods
- Mark Sears - Statistical Physics, Algorithms for Materials Simulation, Multiscale Material Methods
- Stewart Silling - Peridynamic Theory of Continuum Mechanics Simulation of Damage, Fracture and Failure
- Aidan Thompson - Molecular Dynamics Methods, Transition State Theory, Automated Fitting of Interatomic Potentials
Post Doctoral Appointees
- Jeremiah Boerner - Hypersonic Aerodynamics, Direct Simulation Monte Carlo (DSMC)
- Wayne Witzel - Condensed Matter Theory, Quantum Computing Theory, Computer Science
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Snapshot of a Potts model simulation of microstructure evolution in a polycrystalline solid.
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