Affiliated Researchers: Reactive Molecular Dynamics
Affiliates are Penn Staters who have a connection to or an interest in the work of the Institute of Energy and the Environment.
Displaying 10 search result(s) for Reactive Molecular Dynamics.
Yun Kyung Shin
Associate Research Professor, Mechanical Engineering
Top research keywords: ReaxFF, Surface (Surface Science), ReaxFF Reactive Force Field, Computer Simulation, Force Field
Xiawa Wu
Assistant Professor, Mechanical Engineering, School of Engineering (Behrend)
Top research keywords: Cellulose Nanocrystals, Molecular Dynamics Simulation, Molecular Dynamics Study, Computer Simulation, Epoxy
Malgorzata Kowalik
Researcher, Mechanical Engineering
Top research keywords: Graphene, Carbon Fiber, Polyacrylonitrile, ReaxFF, Density
Adri van Duin
Distinguished Professor, Mechanical Engineering
Top research keywords: ReaxFF, Surface (Surface Science), Computer Simulation, Molecular Dynamics Simulation, ReaxFF Reactive Force Field
Kristen Fichthorn
Merrell R. Fenske Professor, Chemical Engineering
Top research keywords: Surface (Surface Science), Molecular Dynamics Simulation, Density, Nanowire, Nanoparticle
Phillip Savage
Professor and Walter L. Robb Family University Department Head, Chemical Engineering
Top research keywords: Supercritical Water, Hydrothermal Liquefaction, Biocrude, Pyrolysis, Reaction Pathway
Jonathan Mathews
Professor, John and Willie Leone Department of Energy & Mineral Engineering (EME)
Top research keywords: Bituminous Coal, Vitrinite, High-resolution Transmission Electron Microscopy (HRTEM), Aromatics, Inertinite
Yuan Xuan
Associate Professor, Mechanical Engineering
Top research keywords: Aromatics, Soot, Sooting Tendency, Flamelets, Pyrolysis
Venkatraman Gopalan
Professor, Materials Science and Engineering
Top research keywords: Ferroelectric Material, Thin Films, Domain Wall, Film, Lithium Tantalate
Susan Sinnott
Department Head and Professor, Materials Science and Engineering
Top research keywords: Molecular Dynamics Simulation, Density, Surface (Surface Science), Carbon Nanotube, Computer Simulation