A Coarse-Grained Reactive Molecular Dynamics Algorithm for Proton Transport In Hydrogen Fuel Cells
Myvizhi Esai Selvan, David J. Keffer, Shengting Cui and Brian J. Edwards, Department of Chemical and Biomolecular Engineering, University of Tennessee, Knoxville, TN 37996 |
A Time Dependent Dielectric Breakdown (TDDB) Model for Field Accelerated Low-K Breakdown Due to COPPER Ions
Joel, L. Plawsky1, William N. Gill2 and Ravi Achanta2, (1)The Isermann Department of Chemical and Biological Engineering, Rensselaer Polytechnic Institute, Ricketts Building, 110, 8th Street, Troy, NY 12180, (2)Rensselaer Polytechnic Institute, 110 8th street, Troy, NY 12180 |
Binary Self-Diffusion In Zsm-5 Lattices
David A. Newsome1, Xin Liu1 and Marc-Olivier Coppens2, (1)Delft University of Technology, DelftChemTech, Julianalaan 136, 2628 BL, Delft, Netherlands, (2)Howard P. Isermann Department of Chemical Engineering, Rensselaer Polytechnic Institute, 110 8th Street, Troy, NY 12180 |
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)Phyiscal 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 |
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 |
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 |
Quantum Effects on Diffusion of Hydrogen Isotopes
Suresh K. Bhatia, Division of Chemical Engineering, The University of Queensland, Brisbane, Australia and A.V. Anil Kumar, Division of Chemical Engineering, The University of Queensland, St. Lucia, Australia |
Self-Diffusion of Alcohols and Water/alcohol Mixtures In Single-Walled Aluminosilicate Nanotubes
Ji Zang, School of Chemical & Biomolecular Engineering, Georgia Institute of Technology, 311 Ferst Drive NW, Atlanta, GA 30332, Suchitra Konduri, School of Chemical and Biomolecular Engineering, Georgia Institute of Technology, 311 Ferst Drive NW, Atlanta, GA 30332-0100, Sankar Nair, School of Chemical & Biomolecular Engineering, Georgia Institute of Technology, 311 Ferst Drive NW, Atlanta, GA 30332-0100 and David S. Sholl, Georgia Institute of Technology, School of Chemical & Biomolecular Engineering, 311 Ferst Drive, N.W., Atlanta, GA 30332-0100 |
The Influence of Surface Barriers on Diffusion of Alkane-Zeolite Systems - a Molecular Dynamics Study
Nils E. R. Zimmermann and Frerich J Keil, Department of Chemical Engineering, Hamburg University of Technology, Eissendorfer Str. 38, Hamburg, 21073, Germany |
Transport In Nanopores: Transient-Time Correlation Function Molecular Simulations
Caroline Desgranges and Jerome Delhommelle, Department of Chemistry, University of North Dakota, 151 Cornell Street Stop 9024, Grand Forks, ND 58202 |
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