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M21.00001: High throughput theoretical and experimental screening of photocatalysts for water splitting
Julian Fanghanel, Quinn Campbell, Catherine Badding, Huaiyu Wang, Jared Mondschein, Yihuang Xiong, Nicole Hall, Kriti Seth, Andrés Villarino, Xavier Quintana, Tiffany Rivera, Nathan Smith, Megan Penrod, Iurii Timrov, Matteo Cococcioni, Senorpe Asem-Hiablie, Venkatraman Gopalan, Héctor Abruña, Raymond Edward Schaak, Ismaila Dabo
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M21.00002: High-Throughput DFT of Solar Thermochemical Perovskite Oxides: Comparison of
Computed and Experimental Thermodynamics
Bianca Baldassarri, Jiangang He, Christopher Mark Wolverton
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M21.00003: Increased Hydrogen Production of Perovskite Solar Thermochemical Water Splitters by Joint Reduction on A and B Sites
Robert Bell, Sarah Shulda, Dan Plattenberger, Sai Gautam Gopalakrishnan, Nicholas Strange, Philip Anthony Parilla, Emily Carter, Anthony McDaniel, Ellen B Stechel, David S Ginley
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M21.00004: Photocatalytic Reaction driven by hot electrons on Plasmon-resonant Grating Nanostructures
Yu Wang, Indu Aravind, Zhi Cai, Lang Shen, George Gibson, Jihan Chen, Bo Wang, Haotian Shi, Boxiang Song, Ernest Guignon, Nathaniel Cady, William Page, Arturo Pilar, Steve Cronin
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M21.00005: Using density functional theory to evaluate Ca-Ce-M-O (M = 3d transition metal) oxide perovskites for solar thermochemical applications
Sai Gautam Gopalakrishnan, Ellen B Stechel, Emily Carter
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M21.00006: Nanoparticle Enhancement of Plasma-driven CO2 reduction to Higher-order Hydrocarbons
Sisi Yang, Bofan Zhao, Indu Aravind, Zhi Cai, Sriram Subramanian, Martin Gundersen, Steve Cronin
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M21.00007: Excitonic Effects in Absorption Spectra of Carbon Dioxide Reduction Photocatalysts
Tathagata Biswas, Tara Boland, Arunima Singh
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M21.00008: Understanding the C1 Selectivity Descriptors in Electrochemical CO2 Reduction for Production of Solar Fuels
Michal Bajdich, Michael T. Tang, Hongjie Peng, Philomena Schlexer Lamoureux, Frank Abild-Pedersen
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M21.00009: CO2 conversion on defect-induced single-layer h-BN
Duy Le, Tao Jiang, Katerina L Chagoya, David J. Nash, Richard Blair, Talat S. Rahman
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M21.00010: Optimizing Power Output of Graphene Energy Harvesting
Ferdinand Harerimana, Paul M Thibado
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M21.00011: Defect chemistry in La/Sr-based oxyhydrides
Andrew Rowberg, Leigh Weston, Chris Van de Walle
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M21.00012: First-Principles Investigation of photo-induced structural change of WO3
Masanori Kaneko, Koichi Yamashita
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M21.00013: Ab-initio investigation of a novel photocathode: bulk and surface properties of CuFeO2
Matteo Ferri, Joshua David Elliott, Matteo Farnesi Camellone, Stefano Fabris, Simone Piccinin
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M21.00014: Linking Nanoscale Grain Boundary Composition and Energetic Properties in Ceramic Oxides
Tara Boland, Arunima Singh, Peter Rez, Peter Crozier
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