A Coarse-Grained Reactive Molecular Dynamics Algorithm for Proton Transport In Hydrogen Fuel Cells
Myvizhi Esai Selvan1, David J. Keffer1, Shengting Cui1 and Brian Edwards2, (1)Department of Chemical and Biomolecular Engineering, University of Tennessee, Knoxville, TN 37996, (2)Chemical and Biomolecular Engineering, The University of Tennessee, 419 Dougherty Hall, Knoxville, TN 37996-2200 |
Flurescence Correlation Spectroscopy in Nanochannels: Confined Diffusion Measurements at a Single Molecule Level
Ilaria De Santo1, Malte Wachsmuth2, Filippo Causa1 and Paolo A. Netti1, (1)Material and Production Engineering, University Federico II of Naples, Naples, 80100, Italy, (2)Cell Biology and Biophysics Unit, EMBL, Heidelberg, 69117, Germany |
I-V Characteristics of Quantum Wire Arrays In the Framework of ETS-4 and ETS-10
Onnaz Ozkanat1, Peter Ryan2, Wei Yi3, Jiangdong Deng4, Nicol McGruer2 and Al Sacco Jr.5, (1)Department of Chemical Engineering, Center for Advanced Microgravity Materials Processing (CAMMP), Northeastern University, 360 Huntington Ave, 147 Snell Engineering Center, Boston, MA 02115, (2)Electrical & Computer Engineering,, Northeastern University, 360 Huntington Avenue, Boston, MA 02115, (3)School of Engineering and Applied Science, Harvard University, 9 Oxford Street, Cambridge, MA 02138, (4)Center for Nanoscale Systems, Harvard University, 9 Oxford Street, Cambridge, MA 02138, (5)Department of Chemical Engineering, Northeastern University, 360 Huntington Avenue, Boston, MA 02115 |
Confinement Effects on Structure and Dynamics of a Supercooled Hard-Sphere Mixture
Mark Pond1, Gaurav Goel1, William P. Krekelberg1, Vincent K. Shen2, Jeffrey R. Errington3 and Thomas M. Truskett4, (1)Department of Chemical Engineering, The University of Texas at Austin, 1 University Station, C0400, Austin, TX 78712, (2)Physical and Chemical Properties Division, NIST, 100 Bureau Dr. MS 8380, Gaithersburg, MD 20899-8380, (3)Chemical and Biological Engineering, University at Buffalo, 303 Furnas Hall, Buffalo, NY 14260, (4)Department of Chemical Engineering and Institute for Theoretical Chemistry, The University of Texas at Austin, 1 University Station, C0400, Austin, TX 78712 |
Molecular Dynamics Simulation of Transport in Silicon Carbide Membranes Using a New Molecular Pore Network Model
Nafiseh Rajabbeigi1, Bahman Elyassi2, Theodore T. Tsotsis2 and Muhammad Sahimi2, (1)Mork Family Department of Chemical Engineering & Materials Science, University of Southern California, 925 Bloom Walk, HED 216, Los Angeles, CA 90089, (2)Mork Family Department of Chemical Engineering & Materials Science, University of Southern California, Los Angeles, CA 90089 |
Graphene Sheets-Oil Nanocomposites: Equilibrium and Transport Properties from Molecular Simulation
Deepthi Konatham, School of Chemical Biological and Materials Engineering, The University of Oklahoma, 100 East Boyd St, Sarkeys Energy Center T-335, Norman, OK 73019 and Alberto Striolo, School of Chemical Biological and Materials Engineering, The University of Oklahoma, Norman, OK 73019 |
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