Tuesday, March 3, 2015
11:15AM - 11:27AM
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G9.00001: Theory of Band Warping and its Effects on Thermoelectronic Transport Properties
Nicholas Mecholsky, Lorenzo Resca, Ian Pegg, Marco Fornari
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Tuesday, March 3, 2015
11:27AM - 11:39AM
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G9.00002: Effective Thermal Properties and Thermal Boundary Resistances of Multiphase Composites Containing Carbon Nanotubes and Inorganic Nanoparticles
Feng Gong, Dimitrios Papavassiliou, Hai Duong
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Tuesday, March 3, 2015
11:39AM - 11:51AM
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G9.00003: Computational Materials Design (CMD$^{\textregistered}$: Realization of the Switching Mechanism in RRAM
Hideaki Kasai, Susan Aspera, Yukio Tamai, Nobuyoshi Awaya, Koukou Suu, Hiro Akinaga
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Tuesday, March 3, 2015
11:51AM - 12:27PM
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G9.00004: High-throughput computational search for new high mobility transparent (semi)conducting oxides
Invited Speaker:
Geoffroy Hautier
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Tuesday, March 3, 2015
12:27PM - 12:39PM
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G9.00005: Transparent Conductive Oxides as Near-IR Plasmonic Materials for Energy Conversion
Arrigo Calzolari, Alice Ruini, Alessandra Catellani, Marco Buongiorno Nardelli
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Tuesday, March 3, 2015
12:39PM - 12:51PM
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G9.00006: Engineering the bandgap of ferroelectric ZnSnO$_3$ via sulfur substitution
Brian Kolb, Alexie Kolpak
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Tuesday, March 3, 2015
12:51PM - 1:03PM
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G9.00007: p-type transparent conducting chalcogenides
Hongliang Shi, Bayrammurad Saparov, David Singh, Athena Sefat, Mao-Hua Du
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Tuesday, March 3, 2015
1:03PM - 1:15PM
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G9.00008: Comparative first principles study for Li, Na, and Mg storage at rutile, anatase, bronze, and amorphous TiO2
Konstantinos Kotsis, Fleur Legrain, Sergei Manzhos
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Tuesday, March 3, 2015
1:15PM - 1:27PM
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G9.00009: Probing for cationic dopants in lanthanum manganite for solid oxide fuel cell applications
Sridevi Krishnan, Vinit Sharma, Manoj K Mahapatra, Prabhakar Singh, Rampi Ramprasad
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Tuesday, March 3, 2015
1:27PM - 1:39PM
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G9.00010: Designing brownmillerite SrCoO$_{2.5}$(BM-SCO) as a cathode material -- a first principles study of oxygen diffusion process in BM-SCO
Chandrima Mitra, Tricia Meyer, Ho Nyung Lee, Fernando Reboredo
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Tuesday, March 3, 2015
1:39PM - 1:51PM
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G9.00011: A DFT study of oxygen reduction reaction on single-atom Pt nanocatalyst
Youngjoo Tak, Norina A. Richter, Aloysius Soon
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Tuesday, March 3, 2015
1:51PM - 2:03PM
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G9.00012: Gold-doped graphene as a cost-effective, highly stable and active electrocatalyst for the oxygen reduction reaction: prediction from first principles
Sergey Stolbov, Marisol Alcantara Ortigoza
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Tuesday, March 3, 2015
2:03PM - 2:15PM
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G9.00013: ABSTRACT WITHDRAWN
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