Bulletin of the American Physical Society

APS March Meeting 2011

Volume 56, Number 1

Monday–Friday, March 21–25, 2011; Dallas, Texas

Session Index

Session X19: Classical and Quantum Molecular Dynamics	Show Abstracts
Sponsoring Units: DCOMP Chair: Isaac Tamblyn, Lawrence Berkeley National Laboratory Room: D170

Thursday, March 24, 2011 2:30PM - 2:42PM		X19.00001: Structure and Dynamics of Shock-Induced Nanobubble Collapse in Water Mohammad Vedadi, Amit Choubey, Ken-ichi Nomura, Rajiv Kalia, Aiichiro Nakano, Priya Vashishta, Adri van Duin Preview Abstract
Thursday, March 24, 2011 2:42PM - 2:54PM		X19.00002: Thermal conductivity of ultra high temperature ceramics (UHTC) $ZrB_2$ and $HfB_2$ from atomistic simulations John Lawson, Murray Daw, Charles Bauschlicher Preview Abstract
Thursday, March 24, 2011 2:54PM - 3:06PM		X19.00003: A robust and monotonically convergent iterative algorithm for solving the Kohn-Sham equations in metallic systems Jean-Luc Fattebert Preview Abstract
Thursday, March 24, 2011 3:06PM - 3:18PM		X19.00004: Molecular Dynamics with Quantum Fluctuations Ionut Georgescu, Jason Deckman, Vladimir Mandelshtam Preview Abstract
Thursday, March 24, 2011 3:18PM - 3:30PM		X19.00005: Biased Monte Carlo technique to accelerate Molecular Dynamics simulations of rare events Pratyush Tiwary, Axel van de Walle Preview Abstract
Thursday, March 24, 2011 3:30PM - 3:42PM		X19.00006: Ab initio molecular dynamics simulations using a Chebyshev-filtered subspace iteration technique for modeling amorphous silicon dioxide Minjung Kim, Khoonghong Khoo, James Chelikowsky Preview Abstract
Thursday, March 24, 2011 3:42PM - 3:54PM		X19.00007: Molecular Dynamics simulations of Carbon-Oxygen mixtures in the Core of White Dwarf Stars Andre da Silva Schneider, Joe Hughto, Charles Horowitz, Don Berry Preview Abstract
Thursday, March 24, 2011 3:54PM - 4:06PM		X19.00008: Diffusion in Yukawa Crystals in White Dwarfs and Neutron Stars Joseph Hughto, Charles Horowitz, Andre Schneider Preview Abstract
Thursday, March 24, 2011 4:06PM - 4:18PM		X19.00009: MD Simulations of the Breaking Strain of Coulomb Crystals in Neutron Stars: Star mountains and gravitational waves Charles Horowitz, Joe Hughto, Andre Schneider, Don Berry Preview Abstract
Thursday, March 24, 2011 4:18PM - 4:30PM		X19.00010: Tracer Diffusion for Rough Hard Spheres Olga Kravchenko, Mark Thachuk Preview Abstract
Thursday, March 24, 2011 4:30PM - 4:42PM		X19.00011: Solvation and thermal effects on the optical properties of naturaldyes: a case study on the flavylium cyanin Arrigo Calzolari, Baris Malcioglu, Ralph Gebauer, Daniele Varsano, Stefano Baroni Preview Abstract
Thursday, March 24, 2011 4:42PM - 4:54PM		X19.00012: ABSTRACT WITHDRAWN Preview Abstract
Thursday, March 24, 2011 4:54PM - 5:06PM		X19.00013: Model inter-atomic potential for Cu-Zr system generated using a multicanonical simulation combined with a first-principles calculation Yoshihide Yoshimoto Preview Abstract

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Bulletin of the American Physical Society

APS March Meeting 2011

Volume 56, Number 1

Monday–Friday, March 21–25, 2011; Dallas, Texas

Session Index

Session X19: Classical and Quantum Molecular Dynamics

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