Wednesday, March 23, 2005
11:15AM - 11:27AM
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P26.00001: Water at a hydrophilic solid surface probed by ab-initio molecular dynamics: inhomogeneous thin layers of dense fluid.
Giancarlo Cicero, Jeffrey Grossman, Alessandra Catellani, Giulia Galli
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Wednesday, March 23, 2005
11:27AM - 11:39AM
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P26.00002: One dimensional growth of styrene on H-Si(001)-(3×1): a Density Functional Theory study.
Noboru Takeuchi, Annabella Selloni
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Wednesday, March 23, 2005
11:39AM - 11:51AM
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P26.00003: Surface Reaction of Alkynes and Alkenes with H-Si(111) : A DFT study
Yosuke Kanai, Noboru Takeuchi, Annabella Selloni
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Wednesday, March 23, 2005
11:51AM - 12:03PM
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P26.00004: Structure, Bonding, and Dynamics of Alkanethylhiolates on Copper and Gold Clusters and Surfaces
Martin Konopka, Roger Rousseau, Ivan Stich, Dominik Marx
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Wednesday, March 23, 2005
12:03PM - 12:15PM
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P26.00005: Strain in Layered Nanocrystals
Youir Bae, Russel Caflisch
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Wednesday, March 23, 2005
12:15PM - 12:27PM
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P26.00006: Molecular Dynamics Simulation of Nanostructured Thin Film Growth
X.W. Zhou, D.A. Murdick, J.J. Quan, B. Gillespie, H.N.G. Wadley, R. Drautz, D.G. Pettifor
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Wednesday, March 23, 2005
12:27PM - 12:39PM
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P26.00007: Self-Teaching Kinetic Monte-Carlo Scheme For Small Cluster Diffusion on Cu(111)
Petr Vikulov, Oleg Trushin, Victor Naumov, Altaf Karim, Abdelkader Kara, Talat S. Rahman
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Wednesday, March 23, 2005
12:39PM - 12:51PM
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P26.00008: Preferential Growth of Pt Particles on Rutile TiO$_2$
Vladimir Skavysh, Hakim Iddir, Serdar Ogut, Nigel Browning
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Wednesday, March 23, 2005
12:51PM - 1:03PM
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P26.00009: Mechanical properties of diamond/a-C nanocomposite films
Ioannis Remediakis, Maria Fyta, Pantelis Kelires
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Wednesday, March 23, 2005
1:03PM - 1:15PM
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P26.00010: Theoretical Investigation of the Vibrational and Electronic Properties of Titanium Carbide Nanocrystals
Qin Zhang, Steven Lewis
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Wednesday, March 23, 2005
1:15PM - 1:27PM
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P26.00011: Evolution of Electronic and Vibrational Polarity of NaF Nanocrystals
Philip B. Allen, Christian Schmidt, Tunna Baruah, Mark R. Pederson
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Wednesday, March 23, 2005
1:27PM - 1:39PM
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P26.00012: Simulations of amorphous nanoparticles: the effect of shape on surface structure and subsequent interactions with the surroundings
Susan Fullerton, Chunxia Chen, Janna Maranas
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Wednesday, March 23, 2005
1:39PM - 1:51PM
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P26.00013: Cage structures based on Polyhedral Oligomeric Silsesquioxanes (POSS) with atomic and ionic impurities
Frank Hagelberg, Sung Soo Park, Chuanyun Xiao, Delwar Hossain, Charles Pittman, Svein Saebo
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P26.00014: Structure of nanocrystals embedded in amorphous carbon
Ioannis Remediakis, Maria Fyta, Pantelis Kelires, Georgios Kopidakis
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