Affiliated Researchers: 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 48 search result(s) for Molecular Dynamics.
Xiawa Wu
Assistant Professor, Mechanical Engineering, School of Engineering (Behrend)
Top research keywords: Cellulose Nanocrystals, Molecular Dynamics Simulation, Molecular Dynamics Study, Pectin, Microcrystalline Cellulose
Adri van Duin
Distinguished Professor, Mechanical Engineering
Top research keywords: ReaxFF, Molecular Dynamics Simulation, ReaxFF Reactive Force Field, Reactive Molecular Dynamics, Reactive Force Field
Yuan Xuan
Associate Professor, Mechanical Engineering
Top research keywords: Sooting Tendency, Soot, ReaxFF Molecular Dynamics, Polycyclic Aromatic Hydrocarbons, Large Eddy Simulation
Malgorzata Kowalik
Researcher, Mechanical Engineering
Top research keywords: Graphene, Carbon Fiber, Polyacrylonitrile, Magnetic Moment, Density
Bladimir Ramos-Alvarado
Associate Professor, Mechanical Engineering
Top research keywords: Proton Exchange Membrane Fuel Cell (PEMFC), Heat Sink, Wettability, Proton-Exchange Membrane Fuel Cells, Thermal Transport
Yun Kyung Shin
Associate Research Professor, Mechanical Engineering
Top research keywords: ReaxFF, ReaxFF Reactive Force Field, Force Field, Molecular Dynamics Simulation, Alloy
Scott A. Showalter
Professor, Chemistry
Top research keywords: Intrinsically Disordered Proteins, Intrinsically Disordered Protein, C-Terminus, RNA, FCP1
Mihail Kantor
Assistant Research Professor, Plant Pathology and Environmental Microbiology
Top research keywords: Nematode, Nematodes, Molecular Characterization, Morphological Characterization, Nematoda
Melik Demirel
Professor, Engineering Science and Mechanics
Top research keywords: Film, Superconducting Quantum Interference Device (SQUID), Nanostructures, Tandem Repeat Protein, Poly(p-xylylene)
Phillip Savage
Distinguished Professor, Chemical Engineering
Top research keywords: Supercritical Water, Hydrothermal Liquefaction, Chemical Kinetics Characteristics, Biocrude, Gasification
Susan Sinnott
Department Head and Professor, Materials Science and Engineering
Top research keywords: Molecular Dynamics Simulation, Density, Surface (Surface Science), Carbon Nanotube, Computer Simulation
John Asbury
Professor, Chemistry
Top research keywords: Ultrafast, Organic Photovoltaics, Electron Transport, Excited State, Organic Solar Cells
Fernando Soto
Assistant Professor of Energy Engineering, Penn State Greater Allegheny
Top research keywords: Solid Electrolyte Interphase, Density, Hydrogen, Lithium, Density Functional Theory
Linghao Zhong
Professor of Chemistry, Penn State Mont Alto
Top research keywords: Molecular Dynamics Simulation, Cellulose Nanofibrils, Cellulose, Trichoderma Reesei, Microcrystalline Cellulose
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), Carbon Dioxide, Coal Char
Mansour Solaimanian
Associate Research Professor, Larson Pennsylvania Transportation Institute
Top research keywords: Asphalt Concrete, Pavement, Asphalt Mixture, Reclaimed Asphalt Pavement, Superpave
Ola Rashwan
Associate Professor in Mechanical Engineering, School of Science, Engineering & Technology (Harrisburg)
Top research keywords: Density, Progressive Model, Modeling Approaches, Solar Cell, New Modeling
Shunli Shang
Research Professor, Materials Science and Engineering
Top research keywords: First-principles Calculations, Alloy, Density, Density Functional Theory, Thermodynamic Properties
Ying Gu
Professor, Biochemistry & Molecular Biology
Top research keywords: Cellulose, Synthase, Cellulose Synthase, Arabidopsis, Microtubules
Gui Becker
Associate Professor, Biology
Top research keywords: Batrachochytrium Dendrobatidis, Amphibian, Amphibians, Infectious Disease, Infection
Kristen Fichthorn
Merrell R. Fenske Professor, Chemical Engineering
Top research keywords: Nanocrystals, Molecular Dynamics Simulation, Density, Nanoparticle, Nanowire
Daniel Haworth
Professor, Mechanical Engineering
Top research keywords: Flame, Turbulence, Radiation, Simulation, Probability Density Function
Onur Apul
Associate Professor, Civil and Environmental Engineering
Top research keywords: Adsorption, Carbon Nanotube, Polyfluoroalkyl Substances, Graphene, Microbubbles
Francisco Dini-Andreote
Associate Professor, Plant Science
Top research keywords: Microbiome, Bacterium, Taxon, Microorganism, Bacterial Community
Manuel Llinás
Professor, Biochemistry & Molecular Biology
Top research keywords: Plasmodium Falciparum, Parasite, Plasmodium, Malaria Parasite, Malaria
Yuka Imamura
Associate Professor, Department of Neuroscience and Experimental Therapeutics
Top research keywords: Gene Expression, Carcinogenesis, RNA Sequencing (RNA-seq), Transcriptome, MicroRNA
Jennifer Gray
Assistant Research Professor, Materials Characterization Lab
Top research keywords: Nanostructure, Film, Quantum Dot, SiGe, Ryugu
William Hancock
Professor, Biomedical Engineering
Top research keywords: Kinesin, Microtubules, Processivity, Motility, Processive
Kurt Vandegrift
Associate Research Professor, Biology
Top research keywords: Virus, Severe Acute Respiratory Syndrome Coronavirus 2, Rodents, COVID-19, White-tailed Deer
Jon-Paul Maria
Professor of Materials Science and Engineering, Materials Science and Engineering
Top research keywords: Thin Films, Film, Oxide Compound, Ferroelectric Material, Dielectric Material
Joseph Najem
Assistant Professor, Mechanical Engineering
Top research keywords: Memristor, Droplet Interface Bilayer, Reservoir Computing, Hydrogel, Biomembranes
John Golbeck
Professor, Biochemistry & Molecular Biology
Top research keywords: Photosystem I Protein Complex, Electrons, Sulfur, Iron, Phylloquinone
Joyce Sakamoto
Assistant Research Professor, Entomology
Top research keywords: Wolbachia, Ixodes Scapularis, I. Scapularis, Wolbachia Infection, Infectious Disease
John Mauro
Department Head and Professor, Materials Science and Engineering
Top research keywords: Aluminosilicate, Silicate Glass, Glass Transition Temperature, Oxide Glass, Sodium
Ming Tien
Professor, Biochemistry & Molecular Biology
Top research keywords: Phanerochaete, Lignin Peroxidase, Manganese Peroxidase, Peroxidase, Lignin
Sergei Koshkin
Assistant Research Professor, Huck Institutes of the Life Sciences
Top research keywords: Lipophilic, Transport Properties, Membrane Transport, Transport Property, Gut Microbiota
Zachary Bitzer
Assistant Professor, Department of Public Health Sciences
Top research keywords: Free Radical, Free Radicals, Electronic Cigarette, Cigarette, Nicotine
Sally Mackenzie
Lloyd and Dottie Huck Chair for Functional Genomics and Professor, Biology
Top research keywords: Mitochondrial Genome, Arabidopsis, Fertility, Plastids, Male Infertility
Kevin Hockett
Associate Professor, Plant Pathology and Environmental Microbiology
Top research keywords: Pseudomonas Syringae, Bacterium, Pseudomonas, Infectious Agent, Microbiome
Charles Anderson
Professor, Biology
Top research keywords: Cellulose, Pectin, Arabidopsis Thaliana, Arabidopsis, Cell Wall
