Bulletin of the American Physical Society

APS March Meeting 2010

Volume 55, Number 2

Monday–Friday, March 15–19, 2010; Portland, Oregon

Session Index

Session P23: Classical and Quantum Molecular Dynamics	Show Abstracts
Sponsoring Units: DCOMP Chair: Glenn Martyna, IBM T.J. Watson Research Center Room: C125-C126

Wednesday, March 17, 2010 8:00AM - 8:12AM		P23.00001: Accelerating Orbital-Free DFT Calculation with a heterogeneous multi-core system Masaru Aoki, Hidekazu Tomono, Kazuo Tsumuraya Preview Abstract
Wednesday, March 17, 2010 8:12AM - 8:24AM		P23.00002: Stochastic Quantum Molecular Dynamics Heiko Appel, Massimiliano Di Ventra Preview Abstract
Wednesday, March 17, 2010 8:24AM - 8:36AM		P23.00003: The Phonostat: Thermostating Phonons in Molecular Dynamics Simulations Rajamani Raghunathan, Alex P. Greaney, Jeffrey C. Grossman Preview Abstract
Wednesday, March 17, 2010 8:36AM - 8:48AM		P23.00004: Gaussian Molecular Dynamics in Imaginary and Real Time Ionut Georgescu, Vladimir Mandelshtam Preview Abstract
Wednesday, March 17, 2010 8:48AM - 9:00AM		P23.00005: Interatomic Potentials for Ultra High Temperature Ceramics (UHTC): ZrB2 and HfB2 John Lawson, Murray Daw, Charles Bauschlicher Preview Abstract
Wednesday, March 17, 2010 9:00AM - 9:12AM		P23.00006: A polarisable atomistic force-field for alumina parametrised using density functional theory Joanne Sarsam, Mike Finnis, Paul Tangney Preview Abstract
Wednesday, March 17, 2010 9:12AM - 9:24AM		P23.00007: Development of an interatomic potential for aluminum oxynitride N. Scott Weingarten, Iskander G. Batyrev, Betsy M. Rice Preview Abstract
Wednesday, March 17, 2010 9:24AM - 9:36AM		P23.00008: A Molecular Dynamics Study of Water Confined Between Hydrophobic Plates Josh Layfield, Diego Troya Preview Abstract
Wednesday, March 17, 2010 9:36AM - 9:48AM		P23.00009: Study of metal oxide nanostructures using molecular dynamics simulation Wun Chet Davy Cheong Preview Abstract
Wednesday, March 17, 2010 9:48AM - 10:00AM		P23.00010: Dynamics of SiO$_2$: A Computer Simulation Landon Chambers, Katharina Vollmayr-Lee, Robin Bjorkquist Preview Abstract
Wednesday, March 17, 2010 10:00AM - 10:12AM		P23.00011: Hybrid QM/MM simulations of liquids with molecule exchange Noam Bernstein, Csilla Varnai, Ivan Solt, Monika Fuxreiter, Gabor Csanyi Preview Abstract
Wednesday, March 17, 2010 10:12AM - 10:24AM		P23.00012: ABSTRACT WITHDRAWN Preview Abstract
Wednesday, March 17, 2010 10:24AM - 10:36AM		P23.00013: High-resolution O(N) DFT method and its application to large-scale nanowire simulations Jean-Luc Fattebert, Sebastien Hamel, Giulia Galli Preview Abstract
Wednesday, March 17, 2010 10:36AM - 10:48AM		P23.00014: GPU implementation of Car-Parrinello molecular dynamics calculations Jacob H. Miner, Rob Farber, John J. Rehr Preview Abstract

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Bulletin of the American Physical Society

APS March Meeting 2010

Volume 55, Number 2

Monday–Friday, March 15–19, 2010; Portland, Oregon

Session Index

Session P23: Classical and Quantum Molecular Dynamics

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