Session Index

Session V27: Computational Methods:Monte Carlo/Molecular Dynamics II

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Abstracts
Sponsoring Units: DCOMP
Chair: Lee Collins, Los Alamos National Laboratory
Room: Baltimore Convention Center 324


Thursday, March 16, 2006
11:15AM - 11:27AM

 V27.00001: Parallel kinetic Monte Carlo simulations of island-coarsening in two dimensions
F. Shi , Y. Shim , J. G. Amar

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Thursday, March 16, 2006
11:27AM - 11:39AM

 V27.00002: Energy optimization of quantum Monte Carlo wave functions
C.J. Umrigar , J. Toulouse

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Thursday, March 16, 2006
11:39AM - 11:51AM

 V27.00003: Monte Carlo Modeling of Luminescent Solar Concentrators
Alex Mooney , Paul Fontecchio , Bruce Wittmershaus

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Thursday, March 16, 2006
11:51AM - 12:03PM

 V27.00004: Efficiency of rejection free Monte Carlo methods
Hiroshi Watanabe , Yukawa Satoshi , Mark A. Novotny , Nobuyasu Ito

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Thursday, March 16, 2006
12:03PM - 12:15PM

 V27.00005: Improved sampling of computationally expensive potentials
Mark Dewing

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Thursday, March 16, 2006
12:15PM - 12:27PM

 V27.00006: Optimally efficient coarse-grained Monte Carlo simulation of rare transition events
Babak Sadigh , Tomas Oppelstrup , Wei Cai , Maurice de Koning , Malvin Kalos , Vasily Buolatov

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Thursday, March 16, 2006
12:27PM - 12:39PM

 V27.00007: Optimized parallel tempering simulations of proteins
Simon Trebst , Matthias Troyer , Ulrich Hansmann

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Thursday, March 16, 2006
12:39PM - 12:51PM

 V27.00008: Hybrid DFT/Thomas-Fermi simulations and applications to biological systems
Miroslav Hodak , Wenchang Lu , Jerry Bernholc

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Thursday, March 16, 2006
12:51PM - 1:03PM

 V27.00009: Environment Dependent Dynamic Charge Interatomic Potential for Silica
Lex Kemper , Krishna Muralidharan , Yingxia Wan , Hai-Ping Cheng

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Thursday, March 16, 2006
1:03PM - 1:15PM

 V27.00010: Universal Dynamic Exponent at the Liquid-Gas Transition from Molecular Dynamics
Subhranil De , An Chen , Eldred Chimowitz , Yonathan Shapir

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Thursday, March 16, 2006
1:15PM - 1:27PM

 V27.00011: Global and local properties used as analyses tools for molecular-dynamics simulations
Martina E. Bachlechner , Jonas T. Anderson , Deng Cao , Robert H. Leonard , Eli T. Owens , Jarrod E. Schiffbauer , Melissa R. Burky , Samuel C. Ducatman , Eric J. Guffey , Fernando Serrano Ramos2

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Thursday, March 16, 2006
1:27PM - 1:39PM

 V27.00012: Molecular Dynamics Simulations of Nanoscratching of 3C-SiC
Alice Noreyan , J.G. Amar

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Thursday, March 16, 2006
1:39PM - 1:51PM

 V27.00013: Charge density wave and phonon softening in the Holstein model: A Quantum Monte Carlo study
Prabuddha Chakraborty , Alexandru Macridin , Richard Scalettar , Warren Pickett , Rajiv Singh

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