Monday, March 18, 2013
2:30PM - 3:06PM
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C5.00001: Computational materials design for energy applications
Invited Speaker:
Vidvuds Ozolins
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Monday, March 18, 2013
3:06PM - 3:18PM
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C5.00002: Design and synthesis of a crystalline LiPON electrolyte
N.A.W. Holzwarth, Keerthi Senevirathne, Cynthia S. Day, Abdessadek Lachgar, Michael D. Gross
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Monday, March 18, 2013
3:18PM - 3:30PM
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C5.00003: Proton Diffusion Model for High-Throughput Calculations
Pandu Wisesa, Tim Mueller
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Monday, March 18, 2013
3:30PM - 3:42PM
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C5.00004: Atomistic level description of phase diagram of gas clathrate hydrates with complex gas compositions
R. Belosludov, H. Mizuseki, Y. Kawazoe, O. Subbotin, V. Belosludov
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Monday, March 18, 2013
3:42PM - 4:18PM
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C5.00005: Materials for Alternative Energies: Computational Materials Discovery and Crystal Structure Prediction
Invited Speaker:
Chris Wolverton
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Monday, March 18, 2013
4:18PM - 4:30PM
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C5.00006: Multigap Semiconducting ferroelectric perovskites
Lai Jiang, Ilya Grinberg, Fenggong Wang, Peter Davies, Andrew Rappe
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Monday, March 18, 2013
4:30PM - 4:42PM
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C5.00007: Search for highly absorbing thin-film photovoltaic absorbers in the system Cu-V-VI from first principles calculations
Liping Yu, Robert S. Kokenyesi, Douglas A. Keszler, Alex Zunger
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Monday, March 18, 2013
4:42PM - 4:54PM
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C5.00008: Accurate surface ionization potentials and electron affinities of semiconductors and insulators, a step toward water splitting predictions
Vladan Stevanovic, Stephan Lany, Alex Zunger
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Monday, March 18, 2013
4:54PM - 5:06PM
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C5.00009: First principle studies of doping effects on the electronic and geometric structures of graphitic C3N4
Sebastian Zuluaga, Sergey Stolbov
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Monday, March 18, 2013
5:06PM - 5:18PM
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C5.00010: Stabilizing and enhancing activity of Ag as a catalyst for oxygen redaction reaction on hydrogen fuel cell cathodes
Sergey Stolbov, Marisol Alcantara Ortigoza
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Monday, March 18, 2013
5:18PM - 5:30PM
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C5.00011: Two dimensional N-containing carbon materials for oxygen reduction reaction
Yexin Feng, Zhenpeng Hu, Lixin Zhang
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