Affiliated Researchers: Atomistic Simulation
Affiliates are Penn Staters who have a connection to or an interest in the work of the Institute of Energy and the Environment.
Displaying 7 search result(s) for Atomistic Simulation.
Jonathan Mathews
Professor, John and Willie Leone Department of Energy & Mineral Engineering (EME)
Top research keywords: Coal, Bituminous Coal, Molecules, Simulation, Vitrinite
Xiawa Wu
Assistant Professor, Mechanical Engineering, School of Engineering (Behrend)
Top research keywords: Cellulose Nanocrystals, Cellulose, Molecular Dynamics, Nanocrystal, Crystalline Materials
Yun Kyung Shin
Associate Research Professor, Mechanical Engineering
Top research keywords: Force, Simulation, Field Theory (physics), Molecular Dynamics, Silica
John Mauro
Professor, Materials Science and Engineering
Top research keywords: Glass, Aluminosilicate Glass, Aluminosilicates, Glass Transition, Silicate Glass
Adri van Duin
Professor and Kenneth Kuan-Yuo Kuo Early Career Professorship, Mechanical Engineering
Top research keywords: Molecular Dynamics, Field Theory (physics), Simulation, Force, Computer Simulation
Susan Sinnott
Department Head and Professor, Materials Science and Engineering
Top research keywords: Molecular Dynamics, Simulation, Many-Body Potential, Density Functional Theory, Computer Simulation
Kristen Fichthorn
Merrell R. Fenske Professor, Chemical Engineering
Top research keywords: Molecular Dynamics, Simulation, Nanocrystals, Surface, Density Functional Theory