Session Index

Session T22: Multiscale Materials (Theory, Modeling and Experiments that Bridge Scales)

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Abstracts
Sponsoring Units: DCOMP GSCCM
Chair: Thomas Sewell, University of Missouri Columbia
Room: Portland Ballroom 252


Wednesday, March 17, 2010
2:30PM - 3:06PM

 T22.00001: Non-Uniqueness in Energy Minimization of Atomistic and Multiscale Problems: A Branch-Following and Bifurcation Investigation
Invited Speaker: Ellad Tadmor

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Wednesday, March 17, 2010
3:06PM - 3:18PM

 T22.00002: Electronic structure calculations at macroscopic scales using orbital-free DFT
Balachandran Gadaguntla Radhakrishnan , Vikram Gavini

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Wednesday, March 17, 2010
3:18PM - 3:30PM

 T22.00003: Quantum Mechanical Simulations of Nanoindentation of Al Thin Film with Mg imurities
Qing Peng , Xu Zhang , Chen Huang , Emily A. Carter , Gang Lu

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Wednesday, March 17, 2010
3:30PM - 3:42PM

 T22.00004: On calculating the equilibrium structure of molecular crystals
Ann E. Mattsson , Ryan R. Wixom , Thomas R. Mattsson

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Wednesday, March 17, 2010
3:42PM - 3:54PM

 T22.00005: Atomistic models of Si nanocrystals embedded in Si-rich nitride and oxide matrices
Tianshu Li , Davide Donadio , Francois Gygi , Giulia Galli

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Wednesday, March 17, 2010
3:54PM - 4:06PM

 T22.00006: A multiphysics numerical technique for THz-frequency carrier transport in semiconductors and metals
K. J. Willis , S. C. Hagness , I. Knezevic

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Wednesday, March 17, 2010
4:06PM - 4:18PM

 T22.00007: Magnetic Resonance and Electrical Conductivity in Mixed Porosity Systems
S. Ryu , Z. Zhang , L. Schwartz , D. Johnson

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Wednesday, March 17, 2010
4:18PM - 4:30PM

 T22.00008: Earthquake Models in the Natural Time Domain
John Rundle , James Holliday

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Wednesday, March 17, 2010
4:30PM - 4:42PM

 T22.00009: Damage Mechanics Model for Fracture Nucleation and Propagation
John Rundle , Gleb Yakovlev , Joseph Gran , Donald Turcotte , William Klein

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Wednesday, March 17, 2010
4:42PM - 4:54PM

 T22.00010: Atomistic Simulation of Lithiated Mesoporous Manganese Dioxide
Phuti E. Ngoepe , Thi X. Sayle , Dean C. Sayle

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Wednesday, March 17, 2010
4:54PM - 5:06PM

 T22.00011: Coupling the atomistic and continuum simulation
Guowu Ren , Dier Zhang , Xingao Gong

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Wednesday, March 17, 2010
5:06PM - 5:18PM

 T22.00012: Locally adaptive parallel temperature accelerated dynamics method
Yunsic Shim , Jacques G. Amar

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