Items where Research Group Name is "JCAP"

Article

Statt, Michael J. and Rohr, Brian A. and Guevarra, Dan et al. (2023) The Materials Provenance Store. Scientific Data, 10 . Art. No. 184. ISSN 2052-4463. PMCID PMC10079965. doi:10.1038/s41597-023-02107-0. https://resolver.caltech.edu/CaltechAUTHORS:20230519-1502000.6

Ifkovits, Zachary P. and Evans, Jake M. and Kempler, Paul A. et al. (2022) Powdered Mn_(y)Sb_(1-y)O_(x) Catalysts for Cerium-Mediated Oxygen Evolution in Acidic Environments. ACS Energy Letters, 7 (12). pp. 4258-4264. ISSN 2380-8195. doi:10.1021/acsenergylett.2c01754. https://resolver.caltech.edu/CaltechAUTHORS:20230125-514893900.22

Segev, Gideon and Kibsgaard, Jakob and Hahn, Christopher et al. (2022) The 2022 solar fuels roadmap. Journal of Physics D: Applied Physics, 55 (32). Art. No. 323003. ISSN 0022-3727. doi:10.1088/1361-6463/ac6f97. https://resolver.caltech.edu/CaltechAUTHORS:20220608-849360000

Yu, Weilai and Buabthong, Pakpoom and Young, James L. et al. (2022) Failure Modes of Platinized pn⁺-GaInP Photocathodes for Solar-Driven H₂ Evolution. ACS Applied Materials & Interfaces, 14 (23). pp. 26622-26630. ISSN 1944-8244. doi:10.1021/acsami.2c01845. https://resolver.caltech.edu/CaltechAUTHORS:20220606-736144000

Chen, Yikai and Lewis, Nathan (2022) Numerical Simulation and Modeling of Hydrogen Gas Evolution on Planar and Microwire Array Electrodes. Journal of the Electrochemical Society, 169 (6). Art. No. 066510. ISSN 0013-4651. doi:10.1149/1945-7111/ac751e. https://resolver.caltech.edu/CaltechAUTHORS:20220606-736390000

Chang, Benjamin K. and Zhou, Jin-Jian and Lee, Nien-En et al. (2022) Intermediate polaronic charge transport in organic crystals from a many-body first-principles approach. npj Computational Materials, 8 . Art. No. 63. ISSN 2057-3960. doi:10.1038/s41524-022-00742-6. https://resolver.caltech.edu/CaltechAUTHORS:20210716-222534684

Kong, Shufeng and Ricci, Francesco and Guevarra, Dan et al. (2022) Density of states prediction for materials discovery via contrastive learning from probabilistic embeddings. Nature Communications, 13 . Art. No. 949. ISSN 2041-1723. doi:10.1038/s41467-022-28543-x. https://resolver.caltech.edu/CaltechAUTHORS:20220222-762467100

Lamaison, Sarah and Wakerley, David and Kracke, Frauke et al. (2022) Designing a Zn–Ag Catalyst Matrix and Electrolyzer System for CO₂ Conversion to CO and Beyond. Advanced Materials, 34 (1). Art. No. 2103963. ISSN 0935-9648. doi:10.1002/adma.202103963. https://resolver.caltech.edu/CaltechAUTHORS:20211130-202117453

Fu, Harold J. and Buabthong, Pakpoom and Ifkovits, Zachary Philip et al. (2022) Catalytic open-circuit passivation by thin metal oxide films of p-Si anodes in aqueous alkaline electrolytes. Energy and Environmental Science, 15 (1). pp. 334-345. ISSN 1754-5692. doi:10.1039/d1ee03040j. https://resolver.caltech.edu/CaltechAUTHORS:20211209-456392000

Truttmann, Tristan K. and Zhou, Jin-Jian and Lu, I-Te et al. (2021) Combined experimental-theoretical study of electron mobility-limiting mechanisms in SrSnO₃. Communications Physics, 4 . Art. No. 241. ISSN 2399-3650. doi:10.1038/s42005-021-00742-w. https://resolver.caltech.edu/CaltechAUTHORS:20211111-210019575

Yu, Weilai and Richter, Matthias H. and Buabthong, Pakpoom et al. (2021) Investigations of the stability of etched or platinized p-InP(100) photocathodes for solar-driven hydrogen evolution in acidic or alkaline aqueous electrolytes. Energy & Environmental Science, 14 (11). pp. 6007-6020. ISSN 1754-5692. doi:10.1039/d1ee02809j. https://resolver.caltech.edu/CaltechAUTHORS:20211117-163656680

Yu, Weilai and Richter, Matthias H. and Simonoff, Ethan et al. (2021) Investigations of the stability of GaAs for photoelectrochemical H₂ evolution in acidic or alkaline aqueous electrolytes. Journal of Materials Chemistry A, 9 (40). pp. 22958-22972. ISSN 2050-7488. doi:10.1039/d1ta04145b. https://resolver.caltech.edu/CaltechAUTHORS:20211008-224606577

Buabthong, Pakpoom and Evans, Jake M. and Rinaldi, Katherine Z. et al. (2021) GaAs Microisland Anodes Protected by Amorphous TiO₂ Films Mitigate Corrosion Spreading During Water Oxidation in Alkaline Electrolytes. ACS Energy Letters, 6 (10). pp. 3709-3714. ISSN 2380-8195. doi:10.1021/acsenergylett.1c01174. https://resolver.caltech.edu/CaltechAUTHORS:20211008-224620533

Yadegari, Hossein and Ozden, Adnan and Alkayyali, Tartela et al. (2021) Glycerol Oxidation Pairs with Carbon Monoxide Reduction for Low-Voltage Generation of C₂ and C₃ Product Streams. ACS Energy Letters, 6 (10). pp. 3538-3544. ISSN 2380-8195. doi:10.1021/acsenergylett.1c01639. https://resolver.caltech.edu/CaltechAUTHORS:20210917-215618208

Kwon, Soonho and Kim, Youn-Geun and Baricuatro, Jack H. et al. (2021) Dramatic Change in the Step Edges of the Cu(100) Electrocatalyst upon Exposure to CO: Operando Observations by Electrochemical STM and Explanation Using Quantum Mechanical Calculations. ACS Catalysis, 11 (19). pp. 12068-12074. ISSN 2155-5435. doi:10.1021/acscatal.1c02844. https://resolver.caltech.edu/CaltechAUTHORS:20210917-215618128

Richter, Matthias H. and Peterson, Elizabeth A. and Zhou, Lan et al. (2021) Band Edge Energy Tuning through Electronic Character Hybridization in Ternary Metal Vanadates. Chemistry of Materials, 33 (18). pp. 7242-7253. ISSN 0897-4756. doi:10.1021/acs.chemmater.1c01415. https://resolver.caltech.edu/CaltechAUTHORS:20210917-215611668

Zhou, Jin-Jian and Park, Jinsoo and Timrov, Iurii et al. (2021) Ab Initio Electron-Phonon Interactions in Correlated Electron Systems. Physical Review Letters, 127 (12). Art. No. 126404. ISSN 0031-9007. doi:10.1103/PhysRevLett.127.126404. https://resolver.caltech.edu/CaltechAUTHORS:20210322-123709144

Yang, Lusann and Haber, Joel A. and Armstrong, Zan et al. (2021) Discovery of complex oxides via automated experiments and data science. Proceedings of the National Academy of Sciences, 118 (37). Art. No. e2106042118. ISSN 0027-8424. PMCID PMC8449358. doi:10.1073/pnas.2106042118. https://resolver.caltech.edu/CaltechAUTHORS:20210914-182227400

Stach, Eric and DeCost, Brian and Kusne, A. Gilad et al. (2021) Autonomous experimentation systems for materials development: A community perspective. Matter, 4 (9). pp. 2702-2726. ISSN 2590-2385. doi:10.1016/j.matt.2021.06.036. https://resolver.caltech.edu/CaltechAUTHORS:20210729-223028773

Ifkovits, Zachary P. and Evans, Jake M. and Meier, Madeline C. et al. (2021) Decoupled electrochemical water-splitting systems: a review and perspective. Energy and Environmental Science, 14 (9). pp. 4740-4759. ISSN 1754-5692. doi:10.1039/d1ee01226f. https://resolver.caltech.edu/CaltechAUTHORS:20210823-225400426

Chen, Di and Bai, Yiwei and Ament, Sebastian et al. (2021) Automating crystal-structure phase mapping by combining deep learning with constraint reasoning. Nature Machine Intelligence, 3 (9). pp. 812-822. ISSN 2522-5839. doi:10.1038/s42256-021-00384-1. https://resolver.caltech.edu/CaltechAUTHORS:20210917-144224516

Guerrero Vela, Pedro Pablo and Polk, James E. and Richter, Matthias H. et al. (2021) Dynamic thermal behavior of polycrystalline LaB₆ hollow cathodes. Journal of Applied Physics, 130 (8). Art. No. 083303. ISSN 0021-8979. doi:10.1063/5.0058607. https://resolver.caltech.edu/CaltechAUTHORS:20210927-225706729

Wang, Lei and Peng, Hongjie and Lamaison, Sarah et al. (2021) Bimetallic effects on Zn-Cu electrocatalysts enhance activity and selectivity for the conversion of CO₂ to CO. Chem Catalysis, 1 (3). pp. 663-680. ISSN 2667-1093. doi:10.1016/j.checat.2021.05.006. https://resolver.caltech.edu/CaltechAUTHORS:20210607-115054455

Nunez, Paul and Cabán-Acevedo, Miguel and Yu, Weilai et al. (2021) Origin of the Electrical Barrier in Electrolessly Deposited Platinum Nanoparticles on p-Si Surfaces. Journal of Physical Chemistry C, 125 (32). pp. 17660-17670. ISSN 1932-7447. doi:10.1021/acs.jpcc.1c03072. https://resolver.caltech.edu/CaltechAUTHORS:20210830-230029107

Buckley, Aya K. and Cheng, Tao and Oh, Myoung Hwan et al. (2021) Approaching 100% Selectivity at Low Potential on Ag for Electrochemical CO₂ Reduction to CO Using a Surface Additive. ACS Catalysis, 11 (15). pp. 9034-9042. ISSN 2155-5435. doi:10.1021/acscatal.1c00830. https://resolver.caltech.edu/CaltechAUTHORS:20210716-164306725

Zhou, Jin-Jian and Park, Jinsoo and Lu, I-Te et al. (2021) Perturbo: A software package for ab initio electron–phonon interactions, charge transport and ultrafast dynamics. Computer Physics Communications, 264 . Art. No. 107970. ISSN 0010-4655. doi:10.1016/j.cpc.2021.107970. https://resolver.caltech.edu/CaltechAUTHORS:20200213-150248226

Liu, Guiji and Lee, Michelle and Kwon, Soonho et al. (2021) CO₂ reduction on pure Cu produces only H₂ after subsurface O is depleted: Theory and experiment. Proceedings of the National Academy of Sciences of the United States of America, 118 (23). Art. No. e2012649118. ISSN 0027-8424. PMCID PMC8201769. doi:10.1073/pnas.2012649118. https://resolver.caltech.edu/CaltechAUTHORS:20210606-014012159

Li, Hao and Kelly, Sara and Guevarra, Dan et al. (2021) Analysis of the limitations in the oxygen reduction activity of transition metal oxide surfaces. Nature Catalysis, 4 (6). pp. 463-468. ISSN 2520-1158. doi:10.1038/s41929-021-00618-w. https://resolver.caltech.edu/CaltechAUTHORS:20210324-112501603

Lee, Nien-En and Chen, Hsiao-Yi and Zhou, Jin-Jian et al. (2021) Facile ab initio approach for self-localized polarons from canonical transformations. Physical Review Materials, 5 (6). Art. No. 063805. ISSN 2475-9953. doi:10.1103/PhysRevMaterials.5.063805. https://resolver.caltech.edu/CaltechAUTHORS:20201203-151018693

Kong, Shufeng and Guevarra, Dan and Gomes, Carla P. et al. (2021) Materials representation and transfer learning for multi-property prediction. Applied Physics Reviews, 8 (2). Art. No. 021409. ISSN 1931-9401. https://resolver.caltech.edu/CaltechAUTHORS:20210626-225301174

Shi, Ye and Ilic, Ognjen and Atwater, Harry A. et al. (2021) All-day fresh water harvesting by microstructured hydrogel membranes. Nature Communications, 12 . Art. No. 2797. ISSN 2041-1723. PMCID PMC8121874. doi:10.1038/s41467-021-23174-0. https://resolver.caltech.edu/CaltechAUTHORS:20210514-114309275

Li, Rengui and Cheng, Wen-Hui and Richter, Matthias H. et al. (2021) Unassisted Highly Selective Gas-Phase CO₂ Reduction with a Plasmonic Au/p-GaN Photocatalyst Using H₂O as an Electron Donor. ACS Energy Letters, 6 (5). pp. 1849-1856. ISSN 2380-8195. doi:10.1021/acsenergylett.1c00392. https://resolver.caltech.edu/CaltechAUTHORS:20210423-164855164

Wen, Yunzhou and Chen, Peining and Wang, Lu et al. (2021) Stabilizing Highly Active Ru Sites by Suppressing Lattice Oxygen Participation in Acidic Water Oxidation. Journal of the American Chemical Society, 143 (17). pp. 6482-6490. ISSN 0002-7863. doi:10.1021/jacs.1c00384. https://resolver.caltech.edu/CaltechAUTHORS:20210503-115704310

Lindley, Sarah A. and An, Qi and Goddard, William A., III et al. (2021) Spatiotemporal Temperature and Pressure in Thermoplasmonic Gold Nanosphere-Water Systems. ACS Nano, 15 (4). pp. 6276-6288. ISSN 1936-0851. doi:10.1021/acsnano.0c09804. https://resolver.caltech.edu/CaltechAUTHORS:20210224-122527044

Thevenon, Arnaud and Rosas-Hernández, Alonso and Fontani-Herreros, Alex M. et al. (2021) Dramatic HER Suppression on Ag Electrodes via Molecular Films for Highly Selective CO₂ to CO Reduction. ACS Catalysis, 11 (8). pp. 4530-4537. ISSN 2155-5435. doi:10.1021/acscatal.1c00338. https://resolver.caltech.edu/CaltechAUTHORS:20210330-144253307

Desai, Dhruv C. and Zviazhynski, Bahdan and Zhou, Jin-Jian et al. (2021) Magnetotransport in semiconductors and two-dimensional materials from first principles. Physical Review B, 103 (16). Art. No. L161103. ISSN 2469-9950. doi:10.1103/PhysRevB.103.L161103. https://resolver.caltech.edu/CaltechAUTHORS:20210210-082533037

Ozden, Adnan and Wang, Yuhang and Li, Fengwang et al. (2021) Cascade CO₂ electroreduction enables efficient carbonate-free production of ethylene. Joule, 5 (3). pp. 706-719. ISSN 2542-4351. doi:10.1016/j.joule.2021.01.007. https://resolver.caltech.edu/CaltechAUTHORS:20210216-140504601

Baricuatro, Jack H. and Kwon, Soonho and Kim, Youn-Geun et al. (2021) Operando Electrochemical Spectroscopy for CO on Cu(100) at pH 1 to 13: Validation of Grand Canonical Potential Predictions. ACS Catalysis, 11 (5). pp. 3173-3181. ISSN 2155-5435. doi:10.1021/acscatal.0c05564. https://resolver.caltech.edu/CaltechAUTHORS:20210225-152852499

Finke, Cody E. and Leandri, Hugo F. and Karumb, Evody Tshijik et al. (2021) Economically advantageous pathways for reducing greenhouse gas emissions from industrial hydrogen under common, current economic conditions. Energy and Environmental Science, 14 (3). pp. 1517-1529. ISSN 1754-5692. doi:10.1039/d0ee03768k. https://resolver.caltech.edu/CaltechAUTHORS:20210217-100658347

Jiang, Hongyan and Tao, Xuecheng and Kammler, Marvin et al. (2021) Small Nuclear Quantum Effects in Scattering of H and D from Graphene. Journal of Physical Chemistry Letters, 12 (7). pp. 1991-1996. ISSN 1948-7185. doi:10.1021/acs.jpclett.0c02933. https://resolver.caltech.edu/CaltechAUTHORS:20210218-150439555

Wang, Jianchun and Cheng, Tao and Fenwick, Aidan Q. et al. (2021) Selective CO₂ Electrochemical Reduction Enabled by a Tricomponent Copolymer Modifier on a Copper Surface. Journal of the American Chemical Society, 143 (7). pp. 2857-2865. ISSN 0002-7863. doi:10.1021/jacs.0c12478. https://resolver.caltech.edu/CaltechAUTHORS:20210216-080252695

Kennedy, Kathleen M. and Kempler, Paul Andrew and Cabán-Acevedo, Miguel et al. (2021) Primary Corrosion Processes for Polymer-Embedded Free-Standing or Substrate-Supported Silicon Microwire Arrays in Aqueous Alkaline Electrolytes. Nano Letters, 21 (2). pp. 1056-1061. ISSN 1530-6984. doi:10.1021/acs.nanolett.0c04298. https://resolver.caltech.edu/CaltechAUTHORS:20210112-091401361

Banin, U. and Waiskopf, N and Hammarström, L. et al. (2021) Nanotechnology for catalysis and solar energy conversion. Nanotechnology, 32 (4). Art. No. 042003. ISSN 0957-4484. doi:10.1088/1361-6528/abbce8. https://resolver.caltech.edu/CaltechAUTHORS:20201106-130122089

Shen, Xin and Yao, Maoqing and Sun, Ke et al. (2021) Defect-Tolerant TiO₂-Coated and Discretized Photoanodes for >600 h of Stable Photoelectrochemical Water Oxidation. ACS Energy Letters, 6 (1). pp. 193-200. ISSN 2380-8195. doi:10.1021/acsenergylett.0c02521. https://resolver.caltech.edu/CaltechAUTHORS:20201217-143607686

Naserifar, Saber and Chen, Yalu and Kwon, Soonho et al. (2021) Artificial Intelligence and QM/MM with a Polarizable Reactive Force Field for Next-Generation Electrocatalysts. Matter, 4 (1). pp. 195-216. ISSN 2590-2385. doi:10.1016/j.matt.2020.11.010. https://resolver.caltech.edu/CaltechAUTHORS:20201204-185233484

Kempler, Paul A. and Ifkovits, Zachary P. and Yu, Weilai et al. (2021) Optical and electrochemical effects of H₂ and O₂ bubbles at upward-facing Si photoelectrodes. Energy and Environmental Science, 14 (1). pp. 414-423. ISSN 1754-5692. doi:10.1039/d0ee02796k. https://resolver.caltech.edu/CaltechAUTHORS:20201124-121041867

Newhouse, Paul F. and Zhou, Lan and Umehara, Mitsutaro et al. (2020) Bi Alloying into Rare Earth Double Perovskites Enhances Synthesizability and Visible Light Absorption. ACS Combinatorial Science, 22 (12). pp. 895-901. ISSN 2156-8952. doi:10.1021/acscombsci.0c00177. https://resolver.caltech.edu/CaltechAUTHORS:20201030-154047149

Sutherland, Duncan R. and Connolly, Aine Boyer and Amsler, Maximilian et al. (2020) Optical Identification of Materials Transformations in Oxide Thin Films. ACS Combinatorial Science, 22 (12). pp. 887-894. ISSN 2156-8952. doi:10.1021/acscombsci.0c00172. https://resolver.caltech.edu/CaltechAUTHORS:20201030-105644203

Flores Espinosa, Michelle M. and Cheng, Tao and Xu, Mingjie et al. (2020) Compressed Intermetallic PdCu for Enhanced Electrocatalysis. ACS Energy Letters, 5 (12). pp. 3672-3680. ISSN 2380-8195. doi:10.1021/acsenergylett.0c01959. https://resolver.caltech.edu/CaltechAUTHORS:20201103-135137512

Baricuatro, Jack H. and Kim, Youn-Geun and Korzeniewski, Carol L. et al. (2020) Tracking the prelude of the electroreduction of carbon monoxide via its interaction with Cu(100): Studies by operando scanning tunneling microscopy and infrared spectroscopy. Catalysis Today, 358 . pp. 210-214. ISSN 0920-5861. doi:10.1016/j.cattod.2020.01.028. https://resolver.caltech.edu/CaltechAUTHORS:20200124-132304036

Goddard, William A., III (2020) New Quantum Mechanics Based Methods for Multiscale Simulations with Applications to Reaction Mechanisms for Electrocatalysis. Topics in Catalysis, 63 (19-20). pp. 1658-1666. ISSN 1022-5528. doi:10.1007/s11244-020-01369-x. https://resolver.caltech.edu/CaltechAUTHORS:20200929-101500549

Tagliabue, Giulia and DuChene, Joseph S. and Abdellah, Mohamed et al. (2020) Ultrafast hot-hole injection modifies hot-electron dynamics in Au/p-GaN heterostructures. Nature Materials, 19 (12). pp. 1312-1318. ISSN 1476-1122. doi:10.1038/s41563-020-0737-1. https://resolver.caltech.edu/CaltechAUTHORS:20181112-073640797

Ribson, Ryan D. and Choi, Gyeongshin and Hadt, Ryan G. et al. (2020) Controlling Singlet Fission with Coordination Chemistry-Induced Assembly of Dipyridyl Pyrrole Bipentacenes. ACS Central Science, 6 (11). pp. 2088-2096. ISSN 2374-7943. PMCID PMC7706079. https://resolver.caltech.edu/CaltechAUTHORS:20200728-104820571

Bui, Justin C. and Digdaya, Ibadillah and Xiang, Chengxiang et al. (2020) Understanding Multi-Ion Transport Mechanisms in Bipolar Membranes. ACS Applied Materials & Interfaces, 12 (47). pp. 52509-52526. ISSN 1944-8244. https://resolver.caltech.edu/CaltechAUTHORS:20201110-121459166

Chen, Yikai and Lewis, Nathan S. and Xiang, Chengxiang (2020) Modeling the Performance of A Flow-Through Gas Diffusion Electrode for Electrochemical Reduction of CO or CO₂. Journal of The Electrochemical Society, 167 (11). Art. No. 114503. ISSN 1945-7111. doi:10.1149/1945-7111/ab987a. https://resolver.caltech.edu/CaltechAUTHORS:20200730-073238681

Newhouse, Paul F. and Guevarra, Dan and Zhou, Lan et al. (2020) Enhanced Bulk Transport in Copper Vanadate Photoanodes Identified by Combinatorial Alloying. Matter, 3 (5). pp. 1601-1613. ISSN 2590-2385. doi:10.1016/j.matt.2020.08.032. https://resolver.caltech.edu/CaltechAUTHORS:20201002-103843089

Zhou, Lan and Shinde, Aniketa and Newhouse, Paul F. et al. (2020) Quaternary Oxide Photoanode Discovery Improves the Spectral Response and Photovoltage of Copper Vanadates. Matter, 3 (5). pp. 1614-1630. ISSN 2590-2385. doi:10.1016/j.matt.2020.08.031. https://resolver.caltech.edu/CaltechAUTHORS:20201002-151459149

Fu, Harold J. and Moreno-Hernandez, Ivan A. and Buabthong, Pakpoom et al. (2020) Enhanced stability of silicon for photoelectrochemical water oxidation through self-healing enabled by an alkaline protective electrolyte. Energy and Environmental Science, 13 (11). pp. 4132-4141. ISSN 1754-5692. doi:10.1039/d0ee02250k. https://resolver.caltech.edu/CaltechAUTHORS:20201016-131847563

Buabthong, Pakpoom and Ifkovits, Zachary P. and Kempler, Paul A. et al. (2020) Failure modes of protection layers produced by atomic layer deposition of amorphous TiO₂ on GaAs anodes. Energy and Environmental Science, 13 (11). pp. 4269-4279. ISSN 1754-5692. doi:10.1039/d0ee02032j. https://resolver.caltech.edu/CaltechAUTHORS:20201007-073929719

Lin, Yi-Rung and Cheng, Wen-Hui and Richter, Matthias H. et al. (2020) Band Edge Tailoring in Few-Layer Two-Dimensional Molybdenum Sulfide/Selenide Alloys. Journal of Physical Chemistry C, 124 (42). pp. 22893-22902. ISSN 1932-7447. doi:10.1021/acs.jpcc.0c04719. https://resolver.caltech.edu/CaltechAUTHORS:20200914-111809687

Baricuatro, Jack H. and Kim, Youn-Geun and Tsang, Chu F. et al. (2020) Reprint of "Selective conversion of CO into ethanol on Cu(511) surface reconstructed from Cu(pc): Operando studies by electrochemical scanning tunneling microscopy, mass spectrometry, quartz crystal nanobalance, and infrared spectroscopy". Journal of Electroanalytical Chemistry, 875 . Art. No. 114757. ISSN 1572-6657. doi:10.1016/j.jelechem.2020.114757. https://resolver.caltech.edu/CaltechAUTHORS:20201013-154709745

Yu, Weilai and Buabthong, Pakpoom and Read, Carlos G. et al. (2020) Cathodic NH₄⁺ leaching of nitrogen impurities in CoMo thin-film electrodes in aqueous acidic solutions. Sustainable Energy and Fuels, 4 (10). pp. 5080-5087. ISSN 2398-4902. doi:10.1039/d0se00674b. https://resolver.caltech.edu/CaltechAUTHORS:20200817-095314564

Choi, Chungseok and Kwon, Soonho and Cheng, Tao et al. (2020) Highly active and stable stepped Cu surface for enhanced electrochemical CO₂ reduction to C₂H₄. Nature Catalysis, 3 (10). pp. 804-812. ISSN 2520-1158. doi:10.1038/s41929-020-00504-x. https://resolver.caltech.edu/CaltechAUTHORS:20200723-121126169

Jhalani, Vatsal A. and Zhou, Jin-Jian and Park, Jinsoo et al. (2020) Piezoelectric Electron-Phonon Interaction from Ab Initio Dynamical Quadrupoles: Impact on Charge Transport in Wurtzite GaN. Physical Review Letters, 125 (13). Art. No. 136602. ISSN 0031-9007. doi:10.1103/PhysRevLett.125.136602. https://resolver.caltech.edu/CaltechAUTHORS:20200420-112051827

Chapovetsky, Alon and Liu, Jeffrey J. and Welborn, Matthew et al. (2020) Electronically Modified Cobalt Aminopyridine Complexes Reveal an Orthogonal Axis for Catalytic Optimization for CO₂ Reduction. Inorganic Chemistry, 59 (18). pp. 13709-13718. ISSN 0020-1669. doi:10.1021/acs.inorgchem.0c02086. https://resolver.caltech.edu/CaltechAUTHORS:20200901-095615539

Park, Jinsoo and Zhou, Jin-Jian and Jhalani, Vatsal A. et al. (2020) Long-range quadrupole electron-phonon interaction from first principles. Physical Review B, 102 (12). Art. No. 125203. ISSN 2469-9950. doi:10.1103/PhysRevB.102.125203. https://resolver.caltech.edu/CaltechAUTHORS:20200518-152636389

Ozden, Adnan and Li, Fengwang and Garcı́a de Arquer, F. Pelayo et al. (2020) High-Rate and Efficient Ethylene Electrosynthesis Using a Catalyst/Promoter/Transport Layer. ACS Energy Letters, 5 (9). pp. 2811-2818. ISSN 2380-8195. doi:10.1021/acsenergylett.0c01266. https://resolver.caltech.edu/CaltechAUTHORS:20200818-072409036

Digdaya, Ibadillah A. and Sullivan, Ian and Lin, Meng et al. (2020) A direct coupled electrochemical system for capture and conversion of CO₂ from oceanwater. Nature Communications, 11 . Art. No. 4412. ISSN 2041-1723. PMCID PMC7474062. doi:10.1038/s41467-020-18232-y. https://resolver.caltech.edu/CaltechAUTHORS:20200909-135831840

Wang, Zhijiang and Yuan, Qi and Shan, Jingjing et al. (2020) Highly Selective Electrocatalytic Reduction of CO₂ into Methane on Cu–Bi Nanoalloys. Journal of Physical Chemistry Letters, 11 (17). pp. 7261-7266. ISSN 1948-7185. doi:10.1021/acs.jpclett.0c01261. https://resolver.caltech.edu/CaltechAUTHORS:20200723-122438908

Kempler, Paul A. and Richter, Matthias H. and Cheng, Wen-Hui et al. (2020) Si Microwire-Array Photocathodes Decorated with Cu Allow CO₂ Reduction with Minimal Parasitic Absorption of Sunlight. ACS Energy Letters, 5 (8). pp. 2528-2534. ISSN 2380-8195. doi:10.1021/acsenergylett.0c01334. https://resolver.caltech.edu/CaltechAUTHORS:20200707-161346609

Yang, Fan and Zhou, Xinghao and Plymale, Noah T. et al. (2020) Evaluation of sputtered nickel oxide, cobalt oxide and nickel–cobalt oxide on n-type silicon photoanodes for solar-driven O₂(g) evolution from water. Journal of Materials Chemistry A, 8 (28). pp. 13955-13963. ISSN 2050-7488. doi:10.1039/d0ta03725g. https://resolver.caltech.edu/CaltechAUTHORS:20200713-130247847

Lee, Soo Hong and Sullivan, Ian and Larson, David M. et al. (2020) Correlating Oxidation State and Surface Area to Activity from Operando Studies of Copper CO Electroreduction Catalysts in a Gas-fed Device. ACS Catalysis, 10 (14). pp. 8000-8011. ISSN 2155-5435. doi:10.1021/acscatal.0c01670. https://resolver.caltech.edu/CaltechAUTHORS:20200626-103612366

Yu, Weilai and Fu, Harold J. and Mueller, Thomas et al. (2020) Atomic force microscopy: Emerging illuminated and operando techniques for solar fuel research. Journal of Chemical Physics, 153 (2). Art. No. 020902. ISSN 0021-9606. doi:10.1063/5.0009858. https://resolver.caltech.edu/CaltechAUTHORS:20200710-151813992

Zhang, Zemin and Lindley, Sarah A. and Guevarra, Dan et al. (2020) Fermi Level Engineering of Passivation and Electron Transport Materials for p-Type CuBi₂O₄ Employing a High‐Throughput Methodology. Advanced Functional Materials, 30 (24). Art. No. 2000948. ISSN 1616-301X. doi:10.1002/adfm.202000948. https://resolver.caltech.edu/CaltechAUTHORS:20200504-153132620

Umehara, Mitsutaro and Zhou, Lan and Haber, Joel A. et al. (2020) Combinatorial synthesis of oxysulfides in the lanthanum-bismuth-copper system. ACS Combinatorial Science, 22 (6). pp. 319-326. ISSN 2156-8952. doi:10.1021/acscombsci.0c00015. https://resolver.caltech.edu/CaltechAUTHORS:20200430-151239863

Ye, Yifan and Qian, Jin and Yang, Hao et al. (2020) Synergy between Silver-Copper Surface Alloy Composition and Carbon Dioxide Adsorption and Activation. ACS Applied Materials & Interfaces, 12 (22). pp. 25374-25382. ISSN 1944-8244. doi:10.1021/acsami.0c02057. https://resolver.caltech.edu/CaltechAUTHORS:20200511-094745730

Kempler, Paul A. and Coridan, Robert H. and Lewis, Nathan S. (2020) Effects of bubbles on the electrochemical behavior of hydrogen-evolving Si microwire arrays oriented against gravity. Energy and Environmental Science, 13 (6). pp. 1808-1817. ISSN 1754-5692. doi:10.1039/d0ee00356e. https://resolver.caltech.edu/CaltechAUTHORS:20200519-103638391

Cao, Jinshan and Cheng, Zhiqiang and Kang, Lijuan et al. (2020) Patterned nanofiber air filters with high optical transparency, robust mechanical strength, and effective PM_(2.5) capture capability. RSC Advances, 10 (34). pp. 20155-20161. ISSN 2046-2069. doi:10.1039/d0ra01967d. https://resolver.caltech.edu/CaltechAUTHORS:20200710-105128397

Tagliabue, Giulia and DuChene, Joseph S. and Habib, Adela et al. (2020) Hot Hole versus Hot Electron Transport at Copper/GaN Heterojunction Interfaces. ACS Nano, 14 (5). pp. 5788-5797. ISSN 1936-0851. doi:10.1021/acsnano.0c00713. https://resolver.caltech.edu/CaltechAUTHORS:20200414-133115396

Moreno-Hernandez, Ivan A. and Yalamanchili, Sisir and Fu, Harold J. et al. (2020) Conformal SnO_x heterojunction coatings for stabilized photoelectrochemical water oxidation using arrays of silicon microcones. Journal of Materials Chemistry A, 8 (18). pp. 9292-9301. ISSN 2050-7488. doi:10.1039/d0ta01144d. https://resolver.caltech.edu/CaltechAUTHORS:20200430-151239546

Chen, Yalu and Cheng, Tao and Goddard, William A., III (2020) Atomistic Explanation of the Dramatically Improved Oxygen Reduction Reaction of Jagged Platinum Nanowires, 50 times better than Pt. Journal of the American Chemical Society, 142 (19). pp. 8625-8632. ISSN 0002-7863. doi:10.1021/jacs.9b13218. https://resolver.caltech.edu/CaltechAUTHORS:20200422-125311157

Zhou, Lan and Shinde, Aniketa and Guevarra, Dan et al. (2020) On the successes and opportunities for discovery of metal oxide photoanodes for solar fuels generators. ACS Energy Letters, 5 (5). pp. 1413-1421. ISSN 2380-8195. doi:10.1021/acsenergylett.0c00067. https://resolver.caltech.edu/CaltechAUTHORS:20200331-093744929

Hossain, Md Delowar and Huang, Yufeng and Yu, Ted H. et al. (2020) Reaction mechanism and kinetics for CO₂ reduction on nickel single atom catalysts from quantum mechanics. Nature Communications, 11 . Art. No. 2256. ISSN 2041-1723. PMCID PMC7205999. doi:10.1038/s41467-020-16119-6. https://resolver.caltech.edu/CaltechAUTHORS:20200511-085432577

Sato, Shunsuke and McNicholas, Brendon J. and Grubbs, Robert H. (2020) Aqueous electrocatalytic CO₂ reduction using metal complexes dispersed in polymer ion gels. Chemical Communications, 56 (32). pp. 4440-4443. ISSN 1359-7345. https://resolver.caltech.edu/CaltechAUTHORS:20200320-095812618

Jiang, Kun and Huang, Yufeng and Zeng, Guosong et al. (2020) Effects of Surface Roughness on the Electrochemical Reduction of CO₂ over Cu. ACS Energy Letters, 5 (4). pp. 1206-1214. ISSN 2380-8195. doi:10.1021/acsenergylett.0c00482. https://resolver.caltech.edu/CaltechAUTHORS:20200319-124814828

Richter, Matthias H. and Lublow, Michael and Papadantonakis, Kimberly M. et al. (2020) Genesis and Propagation of Fractal Structures During Photoelectrochemical Etching of n-Silicon. ACS Applied Materials & Interfaces, 12 (14). pp. 17018-17028. ISSN 1944-8244. doi:10.1021/acsami.9b22900. https://resolver.caltech.edu/CaltechAUTHORS:20200317-132013328

DuChene, Joseph S. and Tagliabue, Giulia and Welch, Alex J. et al. (2020) Optical Excitation of a Nanoparticle Cu/p-NiO Photocathode Improves Reaction Selectivity for CO₂ Reduction in Aqueous Electrolytes. Nano Letters, 20 (4). pp. 2348-2358. ISSN 1530-6984. doi:10.1021/acs.nanolett.9b04895. https://resolver.caltech.edu/CaltechAUTHORS:20200305-145718553

Gauthier, Joseph A. and Chen, Leanne D. and Bajdich, Michal et al. (2020) Implications of the fractional charge of hydroxide at the electrochemical interface. Physical Chemistry Chemical Physics, 22 (13). pp. 6964-6969. ISSN 1463-9076. doi:10.1039/c9cp05952k. https://resolver.caltech.edu/CaltechAUTHORS:20210712-221642048

Yao, Yonggang and Huang, Zhennan and Li, Tangyuan et al. (2020) High-throughput, combinatorial synthesis of multimetallic nanoclusters. Proceedings of the National Academy of Sciences of the United States of America, 117 (12). pp. 6316-6322. ISSN 0027-8424. PMCID PMC7104385. doi:10.1073/pnas.1903721117. https://resolver.caltech.edu/CaltechAUTHORS:20200310-155236320

Rohr, Brian and Stein, Helge S. and Guevarra, Dan et al. (2020) Benchmarking the Acceleration of Materials Discovery by Sequential Learning. Chemical Science, 11 (10). pp. 2696-2706. ISSN 2041-6520. https://resolver.caltech.edu/CaltechAUTHORS:20200110-151145517

Welch, Alex J. and Dunn, Emily and DuChene, Joseph S. et al. (2020) Bicarbonate or Carbonate Processes for Coupling Carbon Dioxide Capture and Electrochemical Conversion. ACS Energy Letters, 5 (3). pp. 940-945. ISSN 2380-8195. doi:10.1021/acsenergylett.0c00234. https://resolver.caltech.edu/CaltechAUTHORS:20200304-074750016

Jeong, Hyung Mo and Kwon, Youngkook and Won, Jong Ho et al. (2020) Atomic-Scale Spacing between Copper Facets for the Electrochemical Reduction of Carbon Dioxide. Advanced Energy Materials, 10 (10). Art. No. 1903423. ISSN 1614-6832. doi:10.1002/aenm.201903423. https://resolver.caltech.edu/CaltechAUTHORS:20200206-111205774

Spitler, Mark T. and Modestino, Miguel A. and Deutsch, Todd G. et al. (2020) Practical challenges in the development of photoelectrochemical solar fuels production. Sustainable Energy and Fuels, 4 (3). pp. 985-995. ISSN 2398-4902. doi:10.1039/c9se00869a. https://resolver.caltech.edu/CaltechAUTHORS:20191219-112734154

Nam, Dae-Hyun and De Luna, Phil and Rosas-Hernández, Alonso et al. (2020) Molecular enhancement of heterogeneous CO₂ reduction. Nature Materials, 19 (3). pp. 266-276. ISSN 1476-1122. doi:10.1038/s41563-020-0610-2. https://resolver.caltech.edu/CaltechAUTHORS:20200302-110558568

Zhou, Lan and Shinde, Aniketa and Guevarra, Dan et al. (2020) Combinatorial screening yields discovery of 29 metal oxide photoanodes for solar fuel generation. Journal of Materials Chemistry A, 8 (8). pp. 4239-4243. ISSN 2050-7488. https://resolver.caltech.edu/CaltechAUTHORS:20200110-145307662

Cheng, Wen-Hui and Richter, Matthias H. and Sullivan, Ian et al. (2020) CO₂ Reduction to CO with 19% Efficiency in a Solar-Driven Gas Diffusion Electrode Flow Cell under Outdoor Solar Illumination. ACS Energy Letters, 5 (2). pp. 470-476. ISSN 2380-8195. doi:10.1021/acsenergylett.9b02576. https://resolver.caltech.edu/CaltechAUTHORS:20200109-143243316

Ge, Lei and Yuan, Hao and Min, Yuxiang et al. (2020) Predicted Optimal Bifunctional Electrocatalysts for the Hydrogen Evolution Reaction and the Oxygen Evolution Reaction Using Chalcogenide Heterostructures Based on Machine Learning Analysis of in Silico Quantum Mechanics Based High Throughput Screening. Journal of Physical Chemistry Letters, 11 (3). pp. 869-876. ISSN 1948-7185. doi:10.1021/acs.jpclett.9b03875. https://resolver.caltech.edu/CaltechAUTHORS:20200113-103102011

Li, Fengwang and Thevenon, Arnaud and Rosas-Hernández, Alonso et al. (2020) Molecular tuning of CO₂-to-ethylene conversion. Nature, 577 (7791). pp. 509-513. ISSN 0028-0836. doi:10.1038/s41586-019-1782-2. https://resolver.caltech.edu/CaltechAUTHORS:20190917-154117893

Baricuatro, Jack H. and Kim, Youn-Geun and Tsang, Chu F. et al. (2020) Selective conversion of CO into ethanol on Cu(511) surface reconstructed from Cu(pc): Operando studies by electrochemical scanning tunneling microscopy, mass spectrometry, quartz crystal nanobalance, and infrared spectroscopy. Journal of Electroanalytical Chemistry, 857 . Art. No. 113704. ISSN 1572-6657. doi:10.1016/j.jelechem.2019.113704. https://resolver.caltech.edu/CaltechAUTHORS:20191202-112107473

Yalamanchili, Sisir and Verlage, Erik and Cheng, Wen-Hui et al. (2020) High Broadband Light Transmission for Solar Fuels Production Using Dielectric Optical Waveguides in TiO₂ Nanocone Arrays. Nano Letters, 20 (1). pp. 502-508. ISSN 1530-6984. doi:10.1021/acs.nanolett.9b04225. https://resolver.caltech.edu/CaltechAUTHORS:20191212-105210937

Kempler, Paul A. and Fu, Harold J. and Ifkovits, Zachary P. et al. (2020) Spontaneous Formation of >90% Optically Transmissive, Electrochemically Active CoP Films for Photoelectrochemical Hydrogen Evolution. Journal of Physical Chemistry Letters, 11 (1). pp. 14-20. ISSN 1948-7185. doi:10.1021/acs.jpclett.9b02926. https://resolver.caltech.edu/CaltechAUTHORS:20191203-081242656

Lai, Yungchieh and Jones, Ryan J. R. and Wang, Yu et al. (2019) The Sensitivity of Cu for Electrochemical Carbon Dioxide Reduction to Hydrocarbons as Revealed by High Throughput Experiments. Journal of Materials Chemistry A, 7 (47). pp. 26785-26790. ISSN 2050-7488. https://resolver.caltech.edu/CaltechAUTHORS:20191105-102648597

Went, Cora M. and Wong, Joeson and Jahelka, Phillip R. et al. (2019) A new metal transfer process for van der Waals contacts to vertical Schottky-junction transition metal dichalcogenide photovoltaics. Science Advances, 5 (12). Art. No. eaax6061. ISSN 2375-2548. PMCID PMC6924982. doi:10.1126/sciadv.aax6061. https://resolver.caltech.edu/CaltechAUTHORS:20190513-082509112

Gauthier, Joseph A. and Fields, Meredith and Bajdich, Michal et al. (2019) Facile Electron Transfer to CO₂ during Adsorption at the Metal | Solution Interface. Journal of Physical Chemistry C, 123 (48). pp. 29278-29283. ISSN 1932-7447. doi:10.1021/acs.jpcc.9b10205. https://resolver.caltech.edu/CaltechAUTHORS:20210707-212629894

Zhou, Jin-Jian and Bernardi, Marco (2019) Predicting Charge Transport in the Presence of Polarons: The Beyond-Quasiparticle Regime in SrTiO₃. Physical Review Research, 1 (3). Art. No. 033138. ISSN 2643-1564. doi:10.1103/PhysRevResearch.1.033138. https://resolver.caltech.edu/CaltechAUTHORS:20191025-161728302

Thevenon, Arnaud and Rosas-Hernández, Alonso and Peters, Jonas C. et al. (2019) In-situ Nanostructuring and Stabilization of Polycrystalline Copper by an Organic Salt Additive Promotes Electrocatalytic CO₂ Reduction to Ethylene. Angewandte Chemie International Edition, 58 (47). pp. 16952-16958. ISSN 1433-7851. doi:10.1002/anie.201907935. https://resolver.caltech.edu/CaltechAUTHORS:20190923-102748967

Noh, Juhwan and Kim, Sungwon and Gu, Geun ho et al. (2019) Unveiling new stable manganese based photoanode materials via theoretical high-throughput screening and experiments. Chemical Communications, 55 (89). pp. 13418-13421. ISSN 1359-7345. doi:10.1039/c9cc06736a. https://resolver.caltech.edu/CaltechAUTHORS:20191023-085621884

Stein, Helge S. and Gregoire, John M. (2019) Progress and prospects for accelerating materials science with automated and autonomous workflows. Chemical Science, 10 (42). pp. 9640-9649. ISSN 2041-6520. PMCID PMC7020936. doi:10.1039/c9sc03766g. https://resolver.caltech.edu/CaltechAUTHORS:20191016-131623439

Yang, Hao and Cheng, Tao and Goddard, William A., III et al. (2019) Design of a One-Dimensional Stacked Spin Peierls System with Room-Temperature Switching from Quantum Mechanical Predictions. Journal of Physical Chemistry Letters, 10 (21). pp. 6432-6437. ISSN 1948-7185. doi:10.1021/acs.jpclett.9b02219. https://resolver.caltech.edu/CaltechAUTHORS:20191003-113813931

Noh, Juhwan and Kim, Jaehoon and Stein, Helge S. et al. (2019) Inverse Design of Solid-State Materials via a Continuous Representation. Matter, 1 (5). pp. 1370-1384. ISSN 2590-2385. doi:10.1016/j.matt.2019.08.017. https://resolver.caltech.edu/CaltechAUTHORS:20191002-094950933

Naserifar, Saber and Oppenheim, Julius J. and Yang, Hao et al. (2019) Accurate non-bonded potentials based on periodic quantum mechanics calculations for use in molecular simulations of materials and systems. Journal of Chemical Physics, 151 (15). Art. No. 154111. ISSN 0021-9606. doi:10.1063/1.5113811. https://resolver.caltech.edu/CaltechAUTHORS:20191023-085026382

Sullivan, Ian and Han, Lihao and Lee, Soo Hong et al. (2019) A Hybrid Catalyst-Bonded Membrane Device for Electrochemical Carbon Monoxide Reduction at Different Relative Humidities. ACS Sustainable Chemistry & Engineering, 7 (20). pp. 16964-16970. ISSN 2168-0485. doi:10.1021/acssuschemeng.9b04959. https://resolver.caltech.edu/CaltechAUTHORS:20190920-113304665

Naserifar, Saber and Goddard, William A., III (2019) Anomalies in Supercooled Water at ~230 K Arise from a 1D Polymer to 2D Network Topological Transformation. Journal of Physical Chemistry Letters, 10 (20). pp. 6267-6273. ISSN 1948-7185. doi:10.1021/acs.jpclett.9b02443. https://resolver.caltech.edu/CaltechAUTHORS:20190930-083231107

Lai, Yungchieh and Jones, Ryan J. R. and Wang, Yu et al. (2019) Scanning electrochemical flow cell with online mass spectroscopy for accelerated screening of carbon dioxide reduction electrocatalysts. ACS Combinatorial Science, 21 (10). pp. 692-704. ISSN 2156-8952. doi:10.1021/acscombsci.9b00130. https://resolver.caltech.edu/CaltechAUTHORS:20190917-112624016

Naserifar, Saber and Goddard, William A., III (2019) Reply to Head-Gordon and Paesani: Liquid water, a branched polymer with ∼100-fs short-lived heterogeneous hydrogen bonds. Proceedings of the National Academy of Sciences of the United States of America, 116 (41). pp. 20257-20258. ISSN 0027-8424. PMCID PMC6789962. doi:10.1073/pnas.1913076116. https://resolver.caltech.edu/CaltechAUTHORS:20190910-124152105

Gregoire, John M. (2019) Unexpected Transitions Yield Interesting Science and High-Performance Materials. Matter, 1 (4). pp. 790-791. ISSN 2590-2385. doi:10.1016/j.matt.2019.09.006. https://resolver.caltech.edu/CaltechAUTHORS:20191002-094950844

Cheng, Tao and Jaramillo-Botero, Andres and An, Qi et al. (2019) First principles-based multiscale atomistic methods for input into first principles nonequilibrium transport across interfaces. Proceedings of the National Academy of Sciences of the United States of America, 116 (37). pp. 18193-18201. ISSN 0027-8424. PMCID PMC6744898. doi:10.1073/pnas.1800035115. https://resolver.caltech.edu/CaltechAUTHORS:20180803-131623344

Yalamanchili, Sisir and Kempler, Paul A. and Papadantonakis, Kimberly M. et al. (2019) Integration of electrocatalysts with silicon microcone arrays for minimization of optical and overpotential losses during sunlight-driven hydrogen evolution. Sustainable Energy and Fuels, 3 (9). pp. 2227-2236. ISSN 2398-4902. doi:10.1039/c9se00294d. https://resolver.caltech.edu/CaltechAUTHORS:20190531-151359075

Shen, Sheng and Zhang, Xiaoyue and Mubeen, Syed et al. (2019) Optimization of the nucleation-site density for the electrodeposition of cadmium sulfide on indium-tin-oxide. Electrochimica Acta, 316 . pp. 105-112. ISSN 0013-4686. doi:10.1016/j.electacta.2019.05.120. https://resolver.caltech.edu/CaltechAUTHORS:20190524-143304992

Gomes, Carla and Gregoire, John (2019) Computational sustainability: computing for a better world and a sustainable future. Communications of the ACM, 62 (9). pp. 56-65. ISSN 0001-0782. doi:10.1145/3339399. https://resolver.caltech.edu/CaltechAUTHORS:20190920-080802370

Jouny, Matthew and Lv, Jing-Jing and Cheng, Tao et al. (2019) Formation of carbon–nitrogen bonds in carbon monoxide electrolysis. Nature Chemistry, 11 (9). pp. 846-851. ISSN 1755-4330. doi:10.1038/s41557-019-0312-z. https://resolver.caltech.edu/CaltechAUTHORS:20190620-142925725

Lin, Meng and Han, Lihao and Singh, Meenesh R. et al. (2019) An Experimental- and Simulation-Based Evaluation on the CO_2 Utilization Efficiency in Aqueous-based Electrochemical CO_2 Reduction Reactors with Ion-Selective Membranes. ACS Applied Energy Materials, 2 (8). pp. 5843-5850. ISSN 2574-0962. doi:10.1021/acsaem.9b00986. https://resolver.caltech.edu/CaltechAUTHORS:20190627-130708138

Nunez, Paul and Richter, Matthias H. and Piercy, Brandon D. et al. (2019) Characterization of Electronic Transport through Amorphous TiO_2 Produced by Atomic-Layer Deposition. Journal of Physical Chemistry C, 123 (33). pp. 20116-20129. ISSN 1932-7447. doi:10.1021/acs.jpcc.9b04434. https://resolver.caltech.edu/CaltechAUTHORS:20190620-093003082

Lee, Sebastian J. R. and Ding, Feizhi and Manby, Frederick R. et al. (2019) Analytical Gradients for Projection-Based Wavefunction-in-DFT Embedding. Journal of Chemical Physics, 151 (6). Art. No. 064112. ISSN 0021-9606. doi:10.1063/1.5109882. https://resolver.caltech.edu/CaltechAUTHORS:20190513-111036074

Zhang, Haochen and Chang, Xiaoxia and Chen, Jingguang G. et al. (2019) Computational and experimental demonstrations of one-pot tandem catalysis for electrochemical carbon dioxide reduction to methane. Nature Communications, 10 . Art. No. 3340. ISSN 2041-1723. PMCID PMC6659690. doi:10.1038/s41467-019-11292-9. https://resolver.caltech.edu/CaltechAUTHORS:20190730-090851748

Soedarmadji, Edwin and Stein, Helge S. and Suram, Santosh K. et al. (2019) Tracking materials science data lineage to manage millions of materials experiments and analyses. npj Computational Materials, 5 . Art. No. 79. ISSN 2057-3960. https://resolver.caltech.edu/CaltechAUTHORS:20190726-101520787

Chen, Yalu and Huang, Yufeng and Cheng, Tao et al. (2019) Identifying Active Sites for CO₂ Reduction on Dealloyed Gold Surfaces by Combining Machine Learning with Multiscale Simulations. Journal of the American Chemical Society, 141 (29). pp. 11651-11657. ISSN 0002-7863. doi:10.1021/jacs.9b04956. https://resolver.caltech.edu/CaltechAUTHORS:20190618-103437881

Ament, Sebastian E. and Stein, Helge S. and Guevarra, Dan et al. (2019) Multi-component background learning automates signal detection for spectroscopic data. npj Computational Materials, 5 . Art. No. 77. ISSN 2057-3960. doi:10.1038/s41524-019-0213-0. https://resolver.caltech.edu/CaltechAUTHORS:20190719-095139134

Stein, Helge S. and Guevarra, Dan and Shinde, Aniketa et al. (2019) Functional mapping reveals mechanistic clusters for OER catalysis across (Cu–Mn–Ta–Co–Sn–Fe)O_x composition and pH space. Materials Horizons, 6 (6). pp. 1251-1258. ISSN 2051-6347. doi:10.1039/c8mh01641k. https://resolver.caltech.edu/CaltechAUTHORS:20190403-094432903

Gomes, Carla P. and Selman, Bart and Gregoire, John M. (2019) Artificial intelligence for materials discovery. MRS Bulletin, 44 (7). pp. 538-544. ISSN 0883-7694. doi:10.1557/mrs.2019.158. https://resolver.caltech.edu/CaltechAUTHORS:20190801-085714793

Jermyn, Adam S. and Tagliabue, Giulia and Atwater, Harry A. et al. (2019) Transport of hot carriers in plasmonic nanostructures. Physical Review Materials, 3 (7). Art. No. 075201. ISSN 2475-9953. doi:10.1103/PhysRevMaterials.3.075201. https://resolver.caltech.edu/CaltechAUTHORS:20190627-130903657

Gomes, Carla P. and Bai, Junwen and Xue, Yexiang et al. (2019) CRYSTAL: a multi-agent AI system for automated mapping of materials' crystal structures. MRS Communications, 9 (2). pp. 600-608. ISSN 2159-6859. doi:10.1557/mrc.2019.50. https://resolver.caltech.edu/CaltechAUTHORS:20190816-090926308

Li, Mufan and Duanmu, Kaining and Wan, Chengzhang et al. (2019) Single-atom tailoring of platinum nanocatalysts for high-performance multifunctional electrocatalysis. Nature Catalysis, 2 (6). pp. 495-503. ISSN 2520-1158. doi:10.1038/s41929-019-0279-6. https://resolver.caltech.edu/CaltechAUTHORS:20190327-094804466

Yao, Yunxi and Shushkov, Philip and Miller, Thomas F., III et al. (2019) Direct dioxygen evolution in collisions of carbon dioxide with surfaces. Nature Communications, 10 . Art. No. 2294. ISSN 2041-1723. PMCID PMC6534623; PMC6582149. doi:10.1038/s41467-019-10342-6. https://resolver.caltech.edu/CaltechAUTHORS:20190524-082754901

Buckley, Aya K. and Lee, Michelle and Cheng, Tao et al. (2019) Electrocatalysis at Organic–Metal Interfaces: Identification of Structure–Reactivity Relationships for CO₂ Reduction at Modified Cu Surfaces. Journal of the American Chemical Society, 141 (18). pp. 7355-7364. ISSN 0002-7863. doi:10.1021/jacs.8b13655. https://resolver.caltech.edu/CaltechAUTHORS:20190506-093522029

Borgwardt, Mario and Omelchenko, Stefan T. and Favaro, Marco et al. (2019) Femtosecond time-resolved two-photon photoemission studies of ultrafast carrier relaxation in Cu_2O photoelectrodes. Nature Communications, 10 . Art. No. 2106. ISSN 2041-1723. PMCID PMC6506537. doi:10.1038/s41467-019-10143-x. https://resolver.caltech.edu/CaltechAUTHORS:20190513-072232965

Qian, Jin and Ye, Yifan and Yang, Hao et al. (2019) Initial steps in forming the electrode electrolyte interface: H_2O adsorption and complex formation on the Ag(111) surface from combining Quantum Mechanics calculations and X-ray Photoelectron Spectroscopy. Journal of the American Chemical Society, 141 (17). pp. 6946-6954. ISSN 0002-7863. doi:10.1021/jacs.8b13672. https://resolver.caltech.edu/CaltechAUTHORS:20190404-092810356

Jiang, Hongyan and Kammler, Marvin and Ding, Feizhi et al. (2019) Imaging covalent bond formation by H atom scattering from graphene. Science, 364 (6438). pp. 379-382. ISSN 0036-8075. doi:10.1126/science.aaw6378. https://resolver.caltech.edu/CaltechAUTHORS:20190425-132430583

Ye, Yifan and Yang, Hao and Qian, Jin et al. (2019) Dramatic differences in carbon dioxide adsorption and initial steps of reduction between silver and copper. Nature Communications, 10 . Art. No. 1875. ISSN 2041-1723. PMCID PMC6478877. doi:10.1038/s41467-019-09846-y. https://resolver.caltech.edu/CaltechAUTHORS:20190423-101937653

Cheng, Tao and Fortunelli, Alessandro and Goddard, William A., III (2019) Reaction intermediates during operando electrocatalysis identified from full solvent quantum mechanics molecular dynamics. Proceedings of the National Academy of Sciences of the United States of America, 116 (16). pp. 7718-7722. ISSN 0027-8424. PMCID PMC6475413. doi:10.1073/pnas.1821709116. https://resolver.caltech.edu/CaltechAUTHORS:20190313-133027865

Ho, Alec and Zhou, Xinghao and Han, Lihao et al. (2019) Decoupling H_2(g) and O_2(g) Production in Water Splitting by a Solar-Driven V^(3+/2)+(aq,H_2SO_4)|KOH(aq) Cell. ACS Energy Letters, 4 (4). pp. 968-976. ISSN 2380-8195. doi:10.1021/acsenergylett.9b00278. https://resolver.caltech.edu/CaltechAUTHORS:20190321-152633678

Moreno-Hernandez, Ivan A. and Brunschwig, Bruce S. and Lewis, Nathan S. (2019) Crystalline nickel, cobalt, and manganese antimonates as electrocatalysts for the chlorine evolution reaction. Energy and Environmental Science, 12 (4). pp. 1241-1248. ISSN 1754-5692. doi:10.1039/c8ee03676d. https://resolver.caltech.edu/CaltechAUTHORS:20190315-102720320

Stein, Helge S. and Soedarmadji, Edwin and Newhouse, Paul F. et al. (2019) Synthesis, optical imaging, and absorption spectroscopy data for 179072 metal oxides. Scientific Data, 6 . Art. No. 9. ISSN 2052-4463. PMCID PMC6437643. doi:10.1038/s41597-019-0019-4. https://resolver.caltech.edu/CaltechAUTHORS:20190327-100527853

Umehara, Mitsutaro and Stein, Helge S. and Guevarra, Dan et al. (2019) Analyzing machine learning models to accelerate generation of fundamental materials insights. npj Computational Materials, 5 . Art. No. 34. ISSN 2057-3960. doi:10.1038/s41524-019-0172-5. https://resolver.caltech.edu/CaltechAUTHORS:20190308-084331413

Choi, Chungseok and Cheng, Tao and Flores Espinosa, Michelle et al. (2019) A Highly Active Star Decahedron Cu Nanocatalyst for Hydrocarbon Production at Low Overpotentials. Advanced Materials, 31 (6). Art. No. 1805405. ISSN 0935-9648. doi:10.1002/adma.201805405. https://resolver.caltech.edu/CaltechAUTHORS:20181221-105357220

Naserifar, Saber and Goddard, William A., III (2019) Liquid water is a dynamic polydisperse branched polymer. Proceedings of the National Academy of Sciences of the United States of America, 116 (6). pp. 1998-2003. ISSN 0027-8424. PMCID PMC6369747. doi:10.1073/pnas.1817383116. https://resolver.caltech.edu/CaltechAUTHORS:20190125-105921884

Huang, Yufeng and Kang, Jun and Goddard, William A., III et al. (2019) Density functional theory based neural network force fields from energy decompositions. Physical Review B, 99 (6). Art. No. 064103. ISSN 2469-9950. doi:10.1103/physrevb.99.064103. https://resolver.caltech.edu/CaltechAUTHORS:20190221-074413398

Welch, Alex J. and DuChene, Joseph S. and Tagliabue, Giulia et al. (2019) Nanoporous Gold as a Highly Selective and Active Carbon Dioxide Reduction Catalyst. ACS Applied Energy Materials, 2 (1). pp. 164-170. ISSN 2574-0962. doi:10.1021/acsaem.8b01570. https://resolver.caltech.edu/CaltechAUTHORS:20190102-092234188

Singh, Arunima K. and Montoya, Joseph H. and Gregoire, John M. et al. (2019) Robust and synthesizable photocatalysts for CO₂ reduction: a data-driven materials discovery. Nature Communications, 10 . Art. No. 443. ISSN 2041-1723. PMCID PMC6347635. doi:10.1038/s41467-019-08356-1. https://resolver.caltech.edu/CaltechAUTHORS:20190129-080508688

Newhouse, P. F. and Guevarra, D. and Umehara, M. et al. (2019) Multi-modal optimization of bismuth vanadate photoanodes via combinatorial alloying and hydrogen processing. Chemical Communications, 55 (4). pp. 489-492. ISSN 1359-7345. doi:10.1039/c8cc07156j. https://resolver.caltech.edu/CaltechAUTHORS:20181217-090927342

Higgins, Drew and Hahn, Christopher and Xiang, Chengxiang et al. (2019) Gas-Diffusion Electrodes for Carbon-Dioxide Reduction: A New Paradigm. ACS Energy Letters, 4 (1). pp. 317-324. ISSN 2380-8195. doi:10.1021/acsenergylett.8b02035. https://resolver.caltech.edu/CaltechAUTHORS:20181217-081303242

Stein, Helge S. and Guevarra, Dan and Newhouse, Paul F. et al. (2019) Machine learning of optical properties of materials - predicting spectra from images and images from spectra. Chemical Science, 10 (1). pp. 47-55. ISSN 2041-6520. PMCID PMC6334722. doi:10.1039/c8sc03077d. https://resolver.caltech.edu/CaltechAUTHORS:20180730-104921622

Alberi, Kirstin and Gregoire, John (2019) The 2019 materials by design roadmap. Journal of Physics D: Applied Physics, 52 (1). Art. No. 013001. ISSN 0022-3727. doi:10.1088/1361-6463/aad926. https://resolver.caltech.edu/CaltechAUTHORS:20181108-080822303

Finke, Cody E. and Omelchenko, Stefan T. and Jasper, Justin T. et al. (2019) Enhancing the activity of oxygen-evolution and chlorine-evolution electrocatalysts by atomic layer deposition of TiO₂. Energy and Environmental Science, 12 (1). pp. 358-365. ISSN 1754-5692. PMCID PMC7680952. doi:10.1039/c8ee02351d. https://resolver.caltech.edu/CaltechAUTHORS:20181217-085437866

Liu, Guiji and Eichhorn, Johanna and Jiang, Chang-Ming et al. (2019) Interface engineering for light-driven water oxidation: unravelling the passivating and catalytic mechanism in BiVO₄ overlayers. Sustainable Energy and Fuels, 3 (1). pp. 127-135. ISSN 2398-4902. doi:10.1039/C8SE00473K. https://resolver.caltech.edu/CaltechAUTHORS:20181116-091613557

Huang, Yufeng and Chen, Yalu and Cheng, Tao et al. (2018) Identification of the Selective Sites for Electrochemical Reduction of CO to C_(2+) Products on Copper Nanoparticles by Combining Reactive Force Fields, Density Functional Theory, and Machine Learning. ACS Energy Letters, 3 (12). pp. 2983-2988. ISSN 2380-8195. doi:10.1021/acsenergylett.8b01933. https://resolver.caltech.edu/CaltechAUTHORS:20181113-112609899

Zhou, Lan and Shinde, Aniketa and Montoya, Joseph H. et al. (2018) Rutile alloys in the Mn-Sb-O system stabilize Mn^(+3) to enable oxygen evolution in strong acid. ACS Catalysis, 8 (12). pp. 10938-10948. ISSN 2155-5435. doi:10.1021/acscatal.8b02689. https://resolver.caltech.edu/CaltechAUTHORS:20181017-092736202

Huang, Yufeng and Nielsen, Robert J. and Goddard, William A., III (2018) The Reaction Mechanism for the Hydrogen Evolution Reaction on the Basal Plane Sulfur Vacancy Site of MoS_2 Using Grand Canonical Potential Kinetics. Journal of the American Chemical Society, 140 (48). pp. 16773-16782. ISSN 0002-7863. doi:10.1021/jacs.8b10016. https://resolver.caltech.edu/CaltechAUTHORS:20181108-141108999

Shen, Heping and Omelchenko, Stefan T. and Jacobs, Daniel A. et al. (2018) In situ recombination junction between p-Si and TiO_2 enables high-efficiency monolithic perovskite/Si tandem cells. Science Advances, 4 (12). Art. No. eaau9711. ISSN 2375-2548. PMCID PMC6294601. doi:10.1126/sciadv.aau9711. https://resolver.caltech.edu/CaltechAUTHORS:20181217-073539652

Jones, Ryan J. R. and Wang, Yu and Lai, Yungchieh et al. (2018) Reactor design and integration with product detection to accelerate screening of electrocatalysts for carbon dioxide reduction. Review of Scientific Instruments, 89 (12). Art. No. 124102. ISSN 0034-6748. doi:10.1063/1.5049704. https://resolver.caltech.edu/CaltechAUTHORS:20190102-092233752

Zhou, Jin-Jian and Hellman, Olle and Bernardi, Marco (2018) Electron-Phonon Scattering in the Presence of Soft Modes and Electron Mobility in SrTiO_3 Perovskite from First Principles. Physical Review Letters, 121 (22). Art. No. 226603. ISSN 0031-9007. doi:10.1103/physrevlett.121.226603. https://resolver.caltech.edu/CaltechAUTHORS:20181130-125158827

Tsang, Chu F. and Javier, Alnald C. and Kim, Youn-Geun et al. (2018) Potential-Dependent Adsorption of CO and Its Low-Overpotential Reduction to CH_3CH_2OH on Cu(511) Surface Reconstructed from Cu(pc): Operando Studies by Seriatim STM-EQCN-DEMS. Journal of the Electrochemical Society, 165 (15). J3350-J3354. ISSN 0013-4651. doi:10.1149/2.0451815jes. https://resolver.caltech.edu/CaltechAUTHORS:20181128-160202260

Zhou, Lan and Shinde, Aniketa and Suram, Santosh K. et al. (2018) Bi-containing n-FeWO_4 Thin Films Provide the Largest Photovoltage and Highest Stability for a sub-2 eV Band Gap Photoanode. ACS Energy Letters, 3 (11). pp. 2769-2774. ISSN 2380-8195. doi:10.1021/acsenergylett.8b01514. https://resolver.caltech.edu/CaltechAUTHORS:20181017-090950761

Zhou, Lan and Shinde, Aniketa and Guevarra, Dan et al. (2018) Balancing Surface Passivation and Catalysis with Integrated BiVO_4/(Fe-Ce)O_x Photoanodes in pH 9 Borate Electrolyte. ACS Applied Energy Materials, 1 (10). pp. 5766-5771. ISSN 2574-0962. doi:10.1021/acsaem.8b01377. https://resolver.caltech.edu/CaltechAUTHORS:20180927-134054550

Welborn, Matthew and Manby, Frederick R. and Miller, Thomas F., III (2018) Even-handed subsystem selection in projection-based embedding. Journal of Chemical Physics, 149 (14). Art. No. 144101. ISSN 0021-9606. doi:10.1063/1.5050533. https://resolver.caltech.edu/CaltechAUTHORS:20181008-145630347

Ardo, Shane and Saadi, Fadl H. (2018) Pathways to electrochemical solar-hydrogen technologies. Energy and Environmental Science, 11 (10). pp. 2768-2783. ISSN 1754-5692. doi:10.1039/c7ee03639f. https://resolver.caltech.edu/CaltechAUTHORS:20180716-131835348

Wang, Lu and Goddard, William A., III and Cheng, Tao et al. (2018) In Silico Optimization of Organic-Inorganic Hybrid Perovskites for Photocatalytic Hydrogen Evolution Reaction in Acidic Solution. Journal of Physical Chemistry C, 122 (36). pp. 20918-20922. ISSN 1932-7447. doi:10.1021/acs.jpcc.8b07380. https://resolver.caltech.edu/CaltechAUTHORS:20180806-125347513

Newhouse, P. F. and Guevarra, D. and Umehara, M. et al. (2018) Combinatorial Alloying Improves Bismuth Vanadate Photoanodes via Reduced Monoclinic Distortion. Energy and Environmental Science, 11 (9). pp. 2444-2457. ISSN 1754-5692. https://resolver.caltech.edu/CaltechAUTHORS:20180423-104401758

Moreno-Hernandez, Ivan A. and Brunschwig, Bruce S. and Lewis, Nathan S. (2018) Tin Oxide as a Protective Heterojunction with Silicon for Efficient Photoelectrochemical Water Oxidation in Strongly Acidic or Alkaline Electrolytes. Advanced Energy Materials, 8 (24). Art. No. 1801155. ISSN 1614-6832. doi:10.1002/aenm.201801155. https://resolver.caltech.edu/CaltechAUTHORS:20180709-131016014

Tagliabue, Giulia and Jermyn, Adam S. and Sundararaman, Ravishankar et al. (2018) Quantifying the role of surface plasmon excitation and hot carrier transport in plasmonic devices. Nature Communications, 9 . Art. No. 3394. ISSN 2041-1723. PMCID PMC6107582. doi:10.1038/s41467-018-05968-x. https://resolver.caltech.edu/CaltechAUTHORS:20180823-080749691

Francis, Sonja A. and Velazquez, Jesus M. and Ferrer, Ivonne M. et al. (2018) Reduction of aqueous CO_2 to 1-Propanol at MoS_2 electrodes. Chemistry of Materials, 30 (15). pp. 4902-4908. ISSN 0897-4756. doi:10.1021/acs.chemmater.7b04428. https://resolver.caltech.edu/CaltechAUTHORS:20180613-162202390

Zhou, Xinghao and Xiang, Chengxiang (2018) Comparative Analysis of Solar-to-Fuel Conversion Efficiency: A Direct, One-Step Electrochemical CO_2 Reduction Reactor versus a Two-Step, Cascade Electrochemical CO_2 Reduction Reactor. ACS Energy Letters, 3 (8). pp. 1892-1897. ISSN 2380-8195. doi:10.1021/acsenergylett.8b01077. https://resolver.caltech.edu/CaltechAUTHORS:20180717-144513102

Cheng, Wen-Hui and Richter, Matthias H. and May, Matthias M. et al. (2018) Monolithic Photoelectrochemical Device for 19% Direct Water Splitting. ACS Energy Letters, 3 (8). pp. 1795-1800. ISSN 2380-8195. doi:10.1021/acsenergylett.8b00920. https://resolver.caltech.edu/CaltechAUTHORS:20170731-084813550

Brinkert, Katharina and Richter, Matthias H. and Akay, Ömer et al. (2018) Advancing semiconductor–electrocatalyst systems: application of surface transformation films and nanosphere lithography. Faraday Discussions, 208 . pp. 523-535. ISSN 1359-6640. doi:10.1039/c8fd00003d. https://resolver.caltech.edu/CaltechAUTHORS:20180524-095254711

Lum, Yanwei and Cheng, Tao and Goddard, William A., III et al. (2018) Electrochemical CO reduction builds solvent water into oxygenate products. Journal of the American Chemical Society, 140 (30). pp. 9337-9340. ISSN 0002-7863. doi:10.1021/jacs.8b03986. https://resolver.caltech.edu/CaltechAUTHORS:20180716-093223969

Swabeck, Joseph K. and Fischer, Stefan and Bronstein, Noah D. et al. (2018) Broadband sensitization of lanthanide emission with indium phosphide quantum dots for visible to NIR downshifting. Journal of the American Chemical Society, 140 (29). pp. 9120-9126. ISSN 0002-7863. doi:10.1021/jacs.8b02612. https://resolver.caltech.edu/CaltechAUTHORS:20180620-153421260

Brinkert, Katharina and Richter, Matthias H. and Akay, Ömer et al. (2018) Efficient solar hydrogen generation in microgravity environment. Nature Communications, 9 . Art. No. 2527. ISSN 2041-1723. PMCID PMC6039473. doi:10.1038/s41467-018-04844-y. https://resolver.caltech.edu/CaltechAUTHORS:20180710-080707049

Clark, Ezra L. and Resasco, Joaquin and Landers, Alan et al. (2018) Data Acquisition Protocols and Reporting Standards for Studies of the Electrochemical Reduction of Carbon Dioxide. ACS Catalysis, 8 (7). pp. 6560-6570. ISSN 2155-5435. doi:10.1021/acscatal.8b01340. https://resolver.caltech.edu/CaltechAUTHORS:20180604-132638553

Kim, Youn-Geun and Baricuatro, Jack H. and Soriaga, Manuel P. (2018) Surface Reconstruction of Polycrystalline Cu Electrodes in Aqueous KHCO_3 Electrolyte at Potentials in the Early Stages of CO_2 Reduction. Electrocatalysis, 9 (4). pp. 526-530. ISSN 1868-2529. doi:10.1007/s12678-018-0469-z. https://resolver.caltech.edu/CaltechAUTHORS:20180411-084932076

Cheng, Tao and Wang, Lu and Merinov, Boris V. et al. (2018) Explanation of Dramatic pH-Dependence of Hydrogen Binding on Noble Metal Electrode: Greatly Weakened Water Adsorption at High pH. Journal of the American Chemical Society, 140 (25). pp. 7787-7790. ISSN 0002-7863. doi:10.1021/jacs.8b04006. https://resolver.caltech.edu/CaltechAUTHORS:20180524-100856381

Landers, Alan T. and Fields, Meredith and Torelli, Daniel A. et al. (2018) The Predominance of Hydrogen Evolution on Transition Metal Sulfides and Phosphides under CO_2 Reduction Conditions: An Experimental and Theoretical Study. ACS Energy Letters, 3 (6). pp. 1450-1457. ISSN 2380-8195. doi:10.1021/acsenergylett.8b00237. https://resolver.caltech.edu/CaltechAUTHORS:20180601-080239556

Wang, Zhijiang and Wu, Lina and Sun, Kun et al. (2018) Surface Ligand Promotion of Carbon Dioxide Reduction through Stabilizing Chemisorbed Reactive Intermediates. Journal of Physical Chemistry Letters, 9 (11). pp. 3057-3061. ISSN 1948-7185. doi:10.1021/acs.jpclett.8b00959. https://resolver.caltech.edu/CaltechAUTHORS:20180522-100408414

Shin, Hyeyoung and Xiao, Hai and Goddard, William A., III (2018) In silico discovery of new dopants for Fe-doped Ni oxyhydroxide (Ni_(1-x)Fe_xOOH) catalysts for oxygen evolution reaction. Journal of the American Chemical Society, 140 (22). pp. 6745-6748. ISSN 0002-7863. doi:10.1021/jacs.8b02225. https://resolver.caltech.edu/CaltechAUTHORS:20180511-100334050

Xiao, Hai and Shin, Hyeyoung and Goddard, William A., III (2018) Synergy between Fe and Ni in the optimal performance of (Ni,Fe)OOH catalysts for the oxygen evolution reaction. Proceedings of the National Academy of Sciences of the United States of America, 115 (23). pp. 5872-5877. ISSN 0027-8424. PMCID PMC6003342. doi:10.1073/pnas.1722034115. https://resolver.caltech.edu/CaltechAUTHORS:20180521-155521778

Baricuatro, Jack H. and Kim, Youn-Geun and Korzeniewski, Carol L. et al. (2018) Seriatim ECSTM-ECPMIRS of the adsorption of carbon monoxide on Cu(100) in alkaline solution at CO_2-reduction potentials. Electrochemistry Communications, 91 . pp. 1-4. ISSN 1388-2481. doi:10.1016/j.elecom.2018.04.016. https://resolver.caltech.edu/CaltechAUTHORS:20180425-144714864

Banerjee, Sriya and Wu, Fei and Myung, Yoon et al. (2018) Amorphous Cu_(2-δ)O as Passivation Layer for Ultra Long Stability of Copper Oxide Nanowires in Photoelectrochemical Environments. Journal of the Electrochemical Society, 165 (7). H417-H424. ISSN 0013-4651. doi:10.1149/2.1131807jes. https://resolver.caltech.edu/CaltechAUTHORS:20180822-111107327

Kafaie Shirmanesh, Ghazaleh and Sokhoyan, Ruzan and Pala, Ragip A. et al. (2018) Dual-Gated Active Metasurface at 1550 nm with Wide (>300°) Phase Tunability. Nano Letters, 18 (5). pp. 2957-2963. ISSN 1530-6984. doi:10.1021/acs.nanolett.8b00351. https://resolver.caltech.edu/CaltechAUTHORS:20180323-134241739

Suram, Santosh K. and Zhou, Lan and Shinde, Aniketa et al. (2018) Alkaline-stable nickel manganese oxides with ideal band gap for solar fuel photoanodes. Chemical Communications, 54 (36). pp. 4625-4628. ISSN 1359-7345. doi:10.1039/c7cc08002f. https://resolver.caltech.edu/CaltechAUTHORS:20180419-092221814

Sun, Ke and Ritzert, Nicole L. and John, Jimmy et al. (2018) Performance and failure modes of Si anodes patterned with thin-film Ni catalyst islands for water oxidation. Sustainable Energy and Fuels, 2 (5). pp. 983-998. ISSN 2398-4902. doi:10.1039/C7SE00583K. https://resolver.caltech.edu/CaltechAUTHORS:20180328-133308643

Cheng, Zhiqiang and Zhao, Shengzhe and Han, Lihao (2018) A novel preparation method for ZnO/γ-Al_2O_3 nanofibers with enhanced absorbability and improved photocatalytic water-treatment performance by Ag nanoparticles. Nanoscale, 10 (15). pp. 6892-6899. ISSN 2040-3364. doi:10.1039/C7NR09683F. https://resolver.caltech.edu/CaltechAUTHORS:20180321-074041990

Han, Lihao and Zhou, Wuzong and Xiang, Chengxiang (2018) High Rate Electrochemical Reduction of Carbon Monoxide to Ethylene using Cu-Nanoparticle-Based Gas Diffusion Electrodes. ACS Energy Letters, 3 (4). pp. 855-860. ISSN 2380-8195. doi:10.1021/acsenergylett.8b00164. https://resolver.caltech.edu/CaltechAUTHORS:20180314-101126488

DuChene, Joseph S. and Tagliabue, Giulia and Welch, Alex J. et al. (2018) Hot Hole Collection and Photoelectrochemical CO_2 Reduction with Plasmonic Au/p-GaN Photocathodes. Nano Letters, 18 (4). pp. 2545-2550. ISSN 1530-6984. doi:10.1021/acs.nanolett.8b00241. https://resolver.caltech.edu/CaltechAUTHORS:20180319-104159108

Chapovetsky, Alon and Welborn, Matthew and Luna, M. et al. (2018) Pendant Hydrogen-Bond Donors in Cobalt Catalysts Independently Enhance CO₂ Reduction. ACS Central Science, 4 (3). pp. 397-404. ISSN 2374-7943. PMCID PMC5879468. doi:10.1021/acscentsci.7b00607. https://resolver.caltech.edu/CaltechAUTHORS:20180315-111119688

Lee, Nien-En and Zhou, Jin-Jian and Agapito, Luis A. et al. (2018) Charge transport in organic molecular semiconductors from first principles: The bandlike hole mobility in a naphthalene crystal. Physical Review B, 97 (11). Art. No. 115203. ISSN 2469-9950. doi:10.1103/PhysRevB.97.115203. https://resolver.caltech.edu/CaltechAUTHORS:20180321-075518336

Kempler, Paul A. and Gonzalez, Miguel A. and Papadantonakis, Kimberly M. et al. (2018) Hydrogen Evolution with Minimal Parasitic Light Absorption by Dense Co–P Catalyst Films on Structured p-Si Photocathodes. ACS Energy Letters, 3 (3). pp. 612-617. ISSN 2380-8195. doi:10.1021/acsenergylett.8b00034. https://resolver.caltech.edu/CaltechAUTHORS:20180220-133422256

Saadi, Fadl H. and Lewis, Nathan S. and McFarland, Eric W. (2018) Relative costs of transporting electrical and chemical energy. Energy and Environmental Science, 11 (3). pp. 469-475. ISSN 1754-5692. https://resolver.caltech.edu/CaltechAUTHORS:20180205-084607037

Hashiba, Hiroshi and Weng, Lien-Chun and Chen, Yikai et al. (2018) Effects of Electrolyte Buffer Capacity on Surface Reactant Species and Reaction Rate of CO_2 in Electrochemical CO_2 Reduction. Journal of Physical Chemistry C, 122 (7). pp. 3719-3726. ISSN 1932-7447. doi:10.1021/acs.jpcc.7b11316. https://resolver.caltech.edu/CaltechAUTHORS:20180131-150900860

Papadakis, Georgia T. and Narang, Prineha and Sundararaman, Ravishankar et al. (2018) Ultralight Angstrom-Scale Optimal Optical Reflectors. ACS Photonics, 5 (2). pp. 384-389. ISSN 2330-4022. doi:10.1021/acsphotonics.7b00609. https://resolver.caltech.edu/CaltechAUTHORS:20171113-093317933

Wang, Lu and Xiao, Hai and Cheng, Tao et al. (2018) Pb-activated Amine-assisted Photocatalytic Hydrogen Evolution Reaction on Organic-Inorganic Perovskites. Journal of the American Chemical Society, 140 (6). pp. 1994-1997. ISSN 0002-7863. doi:10.1021/jacs.7b12028. https://resolver.caltech.edu/CaltechAUTHORS:20180119-111711514

Zhang, Haochen and Goddard, William A., III and Lu, Qi et al. (2018) The importance of grand-canonical quantum mechanical methods to describe the effect of electrode potential on the stability of intermediates involved in both electrochemical CO_2 reduction and hydrogen evolution. Physical Chemistry Chemical Physics, 20 (4). pp. 2549-2557. ISSN 1463-9076. doi:10.1039/c7cp08153g. https://resolver.caltech.edu/CaltechAUTHORS:20180110-102226313

Suram, Santosh K. and Fackler, Sean W. and Zhou, Lan et al. (2018) Combinatorial Discovery of Lanthanum-Tantalum Oxynitride Solar Light Absorbers with Dilute Nitrogen for Solar Fuels Applications. ACS Combinatorial Science, 20 (1). pp. 26-34. ISSN 2156-8952. doi:10.1021/acscombsci.7b00143. https://resolver.caltech.edu/CaltechAUTHORS:20171204-074721984

Soniat, Marielle and Tesfaye, Meron and Brooks, Daniel et al. (2018) Predictive simulation of non-steady-state transport of gases through rubbery polymer membranes. Polymer, 134 . pp. 125-142. ISSN 0032-3861. doi:10.1016/j.polymer.2017.11.055. https://resolver.caltech.edu/CaltechAUTHORS:20171127-141541426

Newhouse, Paul F. and Reyes-Lillo, Sebastian E. and Li, Guo et al. (2017) Discovery and Characterization of a Pourbaix-Stable, 1.8 eV Direct Gap Bismuth Manganate Photoanode. Chemistry of Materials, 29 (23). pp. 10027-10036. ISSN 0897-4756. doi:10.1021/acs.chemmater.7b03591. https://resolver.caltech.edu/CaltechAUTHORS:20171115-095753143

Singh, Arunima K. and Zhou, Lan and Shinde, Aniketa et al. (2017) Electrochemical Stability of Metastable Materials. Chemistry of Materials, 29 (23). pp. 10159-10167. ISSN 0897-4756. doi:10.1021/acs.chemmater.7b03980. https://resolver.caltech.edu/CaltechAUTHORS:20171024-154241789

Shing, Amanda M. and Tolstova, Yulia and Lewis, Nathan S. et al. (2017) Effects of surface condition on the work function and valence-band position of ZnSnN_2. Applied Physics A: Materials Science and Processing, 123 (12). Art. No. 735. ISSN 0947-8396. doi:10.1007/s00339-017-1341-3. https://resolver.caltech.edu/CaltechAUTHORS:20171108-094950631

Kirk, Charlotte and Chen, Leanne D. and Siahrostami, Samira et al. (2017) Theoretical Investigations of the Electrochemical Reduction of CO on Single Metal Atoms Embedded in Graphene. ACS Central Science, 3 (12). pp. 1286-1293. ISSN 2374-7943. PMCID PMC5746853. doi:10.1021/acscentsci.7b00442. https://resolver.caltech.edu/CaltechAUTHORS:20171219-112016737

Paul, J. T. and Singh, A. K. and Dong, Zheng et al. (2017) Computational methods for 2D materials: discovery, property characterization, and application design. Journal of Physics: Condensed Matter, 29 (47). Art. No. 473001. ISSN 0953-8984. https://resolver.caltech.edu/CaltechAUTHORS:20171107-111134229

Jiang, Jingjing and Huang, Zhuangqun and Xiang, Chengxiang et al. (2017) Nanoelectrical and Nanoelectrochemical Imaging of Pt/p-Si and Pt/p+-Si Electrodes. ChemSusChem, 10 (22). pp. 4657-4663. ISSN 1864-5631. doi:10.1002/cssc.201700893. https://resolver.caltech.edu/CaltechAUTHORS:20170627-075439064

Lu, Yu-Jung and Sokhoyan, Ruzan and Cheng, Wen-Hui et al. (2017) Dynamically controlled Purcell enhancement of visible spontaneous emission in a gated plasmonic heterostructure. Nature Communications, 8 . Art. No. 1631. ISSN 2041-1723. PMCID PMC5696373. doi:10.1038/s41467-017-01870-0. https://resolver.caltech.edu/CaltechAUTHORS:20171121-092456068

Fan, Zheng and Xiao, Hai and Wang, Yiliu et al. (2017) Layer-by-Layer Degradation of Methylammonium Lead Tri-iodide Perovskite Microplates. Joule, 1 (3). pp. 548-562. ISSN 2542-4351. doi:10.1016/j.joule.2017.08.005. https://resolver.caltech.edu/CaltechAUTHORS:20170921-103249191

Sun, Kun and Cheng, Tao and Wu, Lina et al. (2017) Ultrahigh Mass Activity for Carbon Dioxide Reduction Enabled by Gold-iron Core-shell Nanoparticles. Journal of the American Chemical Society, 139 (44). pp. 15608-15611. ISSN 0002-7863. doi:10.1021/jacs.7b09251. https://resolver.caltech.edu/CaltechAUTHORS:20171009-111707593

Lichterman, Michael F. and Richter, Matthias H. and Brunschwig, Bruce S. et al. (2017) Operando X-ray photoelectron spectroscopic investigations of the electrochemical double layer at Ir/KOH(aq) interfaces. Journal of Electron Spectroscopy and Related Phenomena, 221 . pp. 99-105. ISSN 0368-2048. doi:10.1016/j.elspec.2017.03.011. https://resolver.caltech.edu/CaltechAUTHORS:20170424-080421711

Wiensch, Joshua D. and John, Jimmy and Velazquez, Jesus M. et al. (2017) Comparative Study in Acidic and Alkaline Media of the Effects of pH and Crystallinity on the Hydrogen-Evolution Reaction on MoS_2 and MoSe_2. ACS Energy Letters, 2 (10). pp. 2234-2238. ISSN 2380-8195. doi:10.1021/acsenergylett.7b00700. https://resolver.caltech.edu/CaltechAUTHORS:20170907-124508456

Shinde, Aniketa and Suram, Santosh K. and Yan, Qimin et al. (2017) Discovery of Manganese-Based Solar Fuel Photoanodes via Integration of Electronic Structure Calculations, Pourbaix Stability Modeling, and High-Throughput Experiments. ACS Energy Letters, 2 (10). pp. 2307-2312. ISSN 2380-8195. doi:10.1021/acsenergylett.7b00607. https://resolver.caltech.edu/CaltechAUTHORS:20170914-131954119

Ulissi, Zachary W. and Tang, Michael T. and Xiao, Jianping et al. (2017) Machine-Learning Methods Enable Exhaustive Searches for Active Bimetallic Facets and Reveal Active Site Motifs for CO_2 Reduction. ACS Catalysis, 7 (10). pp. 6600-6608. ISSN 2155-5435. doi:10.1021/acscatal.7b01648. https://resolver.caltech.edu/CaltechAUTHORS:20170728-081606737

Moreno-Hernandez, Ivan A. and MacFarland, Clara A. and Read, Carlos G. et al. (2017) Crystalline nickel manganese antimonate as a stable water-oxidation catalyst in aqueous 1.0 M H_2SO_4. Energy and Environmental Science, 2017 (10). pp. 2103-2108. ISSN 1754-5692. doi:10.1039/C7EE01486D. https://resolver.caltech.edu/CaltechAUTHORS:20170908-102102710

Saadi, Fadl H. and Carim, Azhar I. and Drisdell, Walter S. et al. (2017) Operando Spectroscopic Analysis of CoP Films Electrocatalyzing the Hydrogen-Evolution Reaction. Journal of the American Chemical Society, 139 (37). pp. 12927-12930. ISSN 0002-7863. doi:10.1021/jacs.7b07606. https://resolver.caltech.edu/CaltechAUTHORS:20170829-095313751

Ding, Feizhi and Tsuchiya, Takashi and Manby, Frederick R. et al. (2017) Linear-response time-dependent embedded mean-field theory. Journal of Chemical Theory and Computation, 13 (9). pp. 4216-4227. ISSN 1549-9618. doi:10.1021/acs.jctc.7b00666. https://resolver.caltech.edu/CaltechAUTHORS:20170816-075909755

Cheng, Tao and Xiao, Hai and Goddard, William A., III (2017) Nature of the active sites for CO reduction on copper nanoparticles; suggestions for optimizing performance. Journal of the American Chemical Society, 139 (34). pp. 11642-11645. ISSN 0002-7863. doi:10.1021/jacs.7b03300. https://resolver.caltech.edu/CaltechAUTHORS:20170816-091808789

Han, Zhiji and Kortlever, Ruud and Chen, Hsiang-Yun et al. (2017) CO_2 Reduction Selective for C_(≥2) Products on Polycrystalline Copper with N-Substituted Pyridinium Additives. ACS Central Science, 3 (8). pp. 853-859. ISSN 2374-7943. PMCID PMC5571460. doi:10.1021/acscentsci.7b00180. https://resolver.caltech.edu/CaltechAUTHORS:20170724-131758454

Thyagarajan, Krishnan and Sokhoyan, Ruzan and Zornberg, Leonardo Z. et al. (2017) Millivolt Modulation of Plasmonic Metasurface Optical Response via Ionic Conductance. Advanced Materials, 29 (31). Art. No. 1701044. ISSN 0935-9648. doi:10.1002/adma.201701044. https://resolver.caltech.edu/CaltechAUTHORS:20161121-085049515

Resasco, Joaquin and Chen, Leanne D. and Clark, Ezra et al. (2017) Promoter effects of alkali metal cations on the electrochemical reduction of carbon dioxide. Journal of the American Chemical Society, 139 (32). pp. 11277-11287. ISSN 0002-7863. doi:10.1021/jacs.7b06765. https://resolver.caltech.edu/CaltechAUTHORS:20170727-084953058

Jhalani, Vatsal A. and Zhou, Jin-Jian and Bernardi, Marco (2017) Ultrafast Hot Carrier Dynamics in GaN and its Impact on the Efficiency Droop. Nano Letters, 17 (8). pp. 5012-5019. ISSN 1530-6984. doi:10.1021/acs.nanolett.7b02212. https://resolver.caltech.edu/CaltechAUTHORS:20170705-124137567

Kim, Taeyong and Ding, Ding and Yim, Jong-Hyuk et al. (2017) Elastic and thermal properties of free-standing molybdenum disulfide membranes measured using ultrafast transient grating spectroscopy. APL Materials, 5 (8). Art. No. 086105. ISSN 2166-532X. doi:10.1063/1.4999225. https://resolver.caltech.edu/CaltechAUTHORS:20170822-070843697

Mauser, Kelly W. and Kim, Seyoon and Mitrovic, Slobodan et al. (2017) Resonant Thermoelectric Nanophotonics. Nature Nanotechnology, 12 (8). pp. 770-775. ISSN 1748-3387. doi:10.1038/NNANO.2017.87. https://resolver.caltech.edu/CaltechAUTHORS:20161004-090725146

Cheng, Tao and Huang, Yufeng and Xiao, Hai et al. (2017) Predicted Structures of the Active Sites Responsible for the Improved Reduction of Carbon Dioxide by Gold Nanoparticles. Journal of Physical Chemistry Letters, 8 (14). pp. 3317-3320. ISSN 1948-7185. doi:10.1021/acs.jpclett.7b01335. https://resolver.caltech.edu/CaltechAUTHORS:20170706-080647539

Liu, J. P. and Kirchhoff, J. and Zhou, L. et al. (2017) X-ray reflectivity measurement of interdiffusion in metallic multilayers during rapid heating. Journal of Synchrotron Radiation, 24 (4). pp. 796-801. ISSN 1600-5775. doi:10.1107/S1600577517008013. https://resolver.caltech.edu/CaltechAUTHORS:20170720-101438771

Xiao, Hai and Goddard, William A. and Cheng, Tao et al. (2017) Cu metal embedded in oxidized matrix catalyst to promote CO₂ activation and CO dimerization for electrochemical reduction of CO₂. Proceedings of the National Academy of Sciences of the United States of America, 114 (26). pp. 6685-6688. ISSN 0027-8424. PMCID PMC5495255. doi:10.1073/pnas.1702405114. https://resolver.caltech.edu/CaltechAUTHORS:20170613-083147382

Favaro, Marco and Xiao, Hai and Cheng, Tao et al. (2017) Subsurface oxide plays a critical role in CO₂ activation by Cu(111) surfaces to form chemisorbed CO₂, the first step in reduction of CO₂. Proceedings of the National Academy of Sciences of the United States of America, 114 (26). pp. 6706-6711. ISSN 0027-8424. PMCID PMC5495248. doi:10.1073/pnas.1701405114. https://resolver.caltech.edu/CaltechAUTHORS:20170613-075002945

He, Lingyun and Zhou, Wu and Cai, Dongping et al. (2017) Pulsed laser-deposited n-Si/NiO_x photoanodes for stable and efficient photoelectrochemical water splitting. Catalysis Science and Technology, 7 (12). pp. 2632-2638. ISSN 2044-4753. doi:10.1039/c7cy00114b. https://resolver.caltech.edu/CaltechAUTHORS:20170526-095044384

Hahn, Christopher and Hatsukade, Toru and Kim, Youn-Geun et al. (2017) Engineering Cu surfaces for the electrocatalytic conversion of CO_2: Controlling selectivity toward oxygenates and hydrocarbons. Proceedings of the National Academy of Sciences of the United States of America, 114 (23). pp. 5918-5923. ISSN 0027-8424. PMCID PMC5468660. doi:10.1073/pnas.1618935114. https://resolver.caltech.edu/CaltechAUTHORS:20170522-125149776

Ledina, M. A. and Bui, N. and Liang, X. et al. (2017) Electrochemical Formation of Germanene: pH 4.5. Journal of the Electrochemical Society, 164 (7). D469-D477. ISSN 0013-4651. doi:10.1149/2.1221707jes. https://resolver.caltech.edu/CaltechAUTHORS:20170728-101828067

Han, Lihao and Lin, Meng and Haussener, Sophia (2017) Reliable Performance Characterization of Mediated Photocatalytic Water-Splitting Half Reactions. ChemSusChem, 10 (10). pp. 2158-2166. ISSN 1864-5631. doi:10.1002/cssc.201601901. https://resolver.caltech.edu/CaltechAUTHORS:20170317-084105989

Fountaine, K. T. and Lewerenz, H. J. (2017) Efficiency Limits for Hydrogen and Formate Production via Fully-Integrated Photoelectrochemical Devices. ECS Transactions, 77 (4). pp. 15-23. ISSN 1938-6737. doi:10.1149/07704.0015ecst. https://resolver.caltech.edu/CaltechAUTHORS:20180914-100811455

Zhou, Xinghao and Liu, Rui and Sun, Ke et al. (2017) Solar-Driven Reduction of 1 atm CO_2 to Formate at 10% Energy-Conversion Efficiency by Use of a TiO_2-Protected III-V Tandem Photoanode in Conjunction with a Bipolar Membrane and a Pd/C Cathode Electrocatalyst. ECS Transactions, 77 (4). pp. 31-41. ISSN 1938-6737. doi:10.1149/07704.0031ecst. https://resolver.caltech.edu/CaltechAUTHORS:20180914-100811320

Kim, Youn-Geun and Javier, Alnald and Baricuatro, Jack H. et al. (2017) Reprint of: Surface reconstruction of pure-Cu single-crystal electrodes under CO-reduction potentials in alkaline solutions: A study by seriatim ECSTM-DEMS. Journal of Electroanalytical Chemistry, 793 . pp. 113-118. ISSN 1572-6657. https://resolver.caltech.edu/CaltechAUTHORS:20171009-095823966

Singh, Meenesh R. and Xiang, Chengxiang and Lewis, Nathan S. (2017) Evaluation of flow schemes for near-neutral pH electrolytes in solar-fuel generators. Sustainable Energy and Fuels, 1 (3). pp. 458-466. ISSN 2398-4902. doi:10.1039/C7SE00062F. https://resolver.caltech.edu/CaltechAUTHORS:20170317-120009870

Ding, Feizhi and Manby, Frederick R. and Miller, Thomas F., III (2017) Embedded Mean-Field Theory with Block-Orthogonalized Partitioning. Journal of Chemical Theory and Computation, 13 (4). pp. 1605-1615. ISSN 1549-9618. doi:10.1021/acs.jctc.6b01065. https://resolver.caltech.edu/CaltechAUTHORS:20170320-094437871

Yao, Yuan and Lee, Kyu-Tae and Sheng, Xing et al. (2017) Porous Nanomaterials for Ultrabroadband Omnidirectional Anti-Reflection Surfaces with Applications in High Concentration Photovoltaics. Advanced Energy Materials, 7 (7). Art. No. 1601992. ISSN 1614-6832. doi:10.1002/aenm.201601992. https://resolver.caltech.edu/CaltechAUTHORS:20170410-080135691

Bouabadi, B. and Aggour, M. and Lewerenz, H.-J. et al. (2017) Enhanced plasmon-mediated photo-assisted hydrogen evolution on silicon by interfacial modification. Journal of Applied Electrochemistry, 47 (4). pp. 457-466. ISSN 0021-891X. doi:10.1007/s10800-017-1055-4. https://resolver.caltech.edu/CaltechAUTHORS:20170505-095702134

Sun, Ke and Moreno-Hernandez, Ivan A. and Schmidt, William C. et al. (2017) A comparison of the chemical, optical and electrocatalytic properties of water-oxidation catalysts for use in integrated solar-fuel generators. Energy and Environmental Science, 10 (4). pp. 987-1002. ISSN 1754-5692. doi:10.1039/C6EE03563A. https://resolver.caltech.edu/CaltechAUTHORS:20170331-105139021

Naserifar, Saber and Brooks, Daniel J. and Goddard, William A., III et al. (2017) Polarizable charge equilibration model for predicting accurate electrostatic interactions in molecules and solids. Journal of Chemical Physics, 146 (12). Art. No. 124117. ISSN 0021-9606. doi:10.1063/1.4978891. https://resolver.caltech.edu/CaltechAUTHORS:20170410-141114724

Sundararaman, Ravishankar and Goddard, William A., III and Arias, Tomas A. (2017) Grand canonical electronic density-functional theory: Algorithms and applications to electrochemistry. Journal of Chemical Physics, 146 (11). Art. No. 114104. ISSN 0021-9606. doi:10.1063/1.4978411. https://resolver.caltech.edu/CaltechAUTHORS:20170316-155448902

Yan, Qimin and Yu, Jie and Suram, Santosh K. et al. (2017) Solar fuels photoanode materials discovery by integrating high-throughput theory and experiment. Proceedings of the National Academy of Sciences of the United States of America, 114 (12). pp. 3040-3043. ISSN 0027-8424. PMCID PMC5373381. doi:10.1073/pnas.1619940114. https://resolver.caltech.edu/CaltechAUTHORS:20170306-150101767

Nellist, Michael R. and Chen, Yikai and Mark, Andreas et al. (2017) Atomic force microscopy with nanoelectrode tips for high resolution electrochemical, nanoadhesion and nanoelectrical imaging. Nanotechnology, 28 (9). Art. No. 095711. ISSN 0957-4484. doi:10.1088/1361-6528/aa5839. https://resolver.caltech.edu/CaltechAUTHORS:20170131-095024118

Green, M. L. and Choi, C. L. and Hattrick-Simpers, J. R. et al. (2017) Fulfilling the promise of the materials genome initiative with high-throughput experimental methodologies. Applied Physics Reviews, 4 (1). Art. No. 011105. ISSN 1931-9401. doi:10.1063/1.4977487. https://resolver.caltech.edu/CaltechAUTHORS:20170616-160215339

Bukowsky, Colton R. and Grandidier, Jonathan and Fountaine, Katherine T. et al. (2017) Photon and carrier management design for nonplanar thin-film copper indium gallium selenide photovoltaics. Solar Energy Materials and Solar Cells, 161 . pp. 149-156. ISSN 0927-0248. doi:10.1016/j.solmat.2016.11.008. https://resolver.caltech.edu/CaltechAUTHORS:20161212-115220770

Brown, Ana M. and Sundararaman, Ravishankar and Narang, Prineha et al. (2017) Experimental and Ab Initio Ultrafast Carrier Dynamics in Plasmonic Nanoparticles. Physical Review Letters, 118 (8). Art. No. 087401. ISSN 0031-9007. doi:10.1103/PhysRevLett.118.087401. https://resolver.caltech.edu/CaltechAUTHORS:20170221-134853641

Cheng, Tao and Xiao, Hai and Goddard, William A., III (2017) Full atomistic reaction mechanism with kinetics for CO reduction on Cu(100) from ab initio molecular dynamics free-energy calculations at 298 K. Proceedings of the National Academy of Sciences of the United States of America, 114 (8). pp. 1795-1800. ISSN 0027-8424. PMCID PMC5338443. doi:10.1073/pnas.1612106114. https://resolver.caltech.edu/CaltechAUTHORS:20170207-102433252

Javier, A. and Baricuatro, J. H. and Kim, Y.-G. et al. (2017) Electrocatalytic Reduction of CO_2 on Cu and Au/W Electrode Surfaces: Empirical (DEMS) Confirmation of Computational (DFT) Predictions. ECS Transactions, 75 (48). pp. 1-17. ISSN 1938-6737. doi:10.1149/07548.0001ecst. https://resolver.caltech.edu/CaltechAUTHORS:20180914-100811125

Kim, Y.-G. and Baricuatro, J. H. and Javier, A. et al. (2017) Tuning the CO-Reduction Product Distribution by Structural Modification of the Cu Electrode Surface. ECS Transactions, 75 (50). pp. 87-97. ISSN 1938-6737. doi:10.1149/07550.0087ecst. https://resolver.caltech.edu/CaltechAUTHORS:20180914-100811230

Omelchenko, Stefan T. and Tolstova, Yulia and Atwater, Harry A. et al. (2017) Excitonic Effects in Emerging Photovoltaic Materials: A Case Study in Cu_2O. ACS Energy Letters, 2 (2). pp. 431-437. ISSN 2380-8195. doi:10.1021/acsenergylett.6b00704. https://resolver.caltech.edu/CaltechAUTHORS:20170126-105722527

Favaro, Marco and Drisdell, Walter S. and Marcus, Matthew A. et al. (2017) An Operando Investigation of (Ni-Fe-Co-Ce)O_x System as Highly Efficient Electrocatalyst for Oxygen Evolution Reaction. ACS Catalysis, 7 (2). pp. 1248-1258. ISSN 2155-5435. doi:10.1021/acscatal.6b03126. https://resolver.caltech.edu/CaltechAUTHORS:20170104-105146889

Tolstova, Yulia and Omelchenko, Stefan T. and Blackwell, Raymond E. et al. (2017) Polycrystalline Cu_(2)O photovoltaic devices incorporating Zn(O,S) window layers. Solar Energy Materials and Solar Cells, 160 . pp. 340-345. ISSN 0927-0248. doi:10.1016/j.solmat.2016.10.049. https://resolver.caltech.edu/CaltechAUTHORS:20161114-145632587

Cheng, Tao and Goddard, William A., III and An, Qi et al. (2017) Mechanism and kinetics of the electrocatalytic reaction responsible for the high cost of hydrogen fuel cells. Physical Chemistry Chemical Physics, 19 (4). pp. 2666-2673. ISSN 1463-9076. doi:10.1039/c6cp08055c. https://resolver.caltech.edu/CaltechAUTHORS:20170109-143914060

Xiao, Hai and Cheng, Tao and Goddard, William A., III (2017) Atomistic Mechanisms Underlying Selectivities in C_1 and C_2 Products from Electrochemical Reduction of CO on Cu(111). Journal of the American Chemical Society, 139 (1). pp. 130-136. ISSN 0002-7863. doi:10.1021/jacs.6b06846. https://resolver.caltech.edu/CaltechAUTHORS:20161209-133639283

Ping, Yuan and Nielsen, Robert J. and Goddard, William A. (2017) The Reaction Mechanism with Free Energy Barriers at Constant Potentials for the Oxygen Evolution Reaction at the IrO_2 (110) Surface. Journal of the American Chemical Society, 139 (1). pp. 149-155. ISSN 0002-7863. doi:10.1021/jacs.6b07557. https://resolver.caltech.edu/CaltechAUTHORS:20161213-102614547

Suram, Santosh K. and Xue, Yexiang and Bai, Junwen et al. (2017) Automated Phase Mapping with AgileFD and its Application to Light Absorber Discovery in the V-Mn-Nb Oxide System. ACS Combinatorial Science, 19 (1). pp. 37-46. ISSN 2156-8952. doi:10.1021/acscombsci.6b00153. https://resolver.caltech.edu/CaltechAUTHORS:20161205-104618599

Jung, Suho and Kortlever, Ruud and Jones, Ryan J. R. et al. (2017) Gastight Hydrodynamic Electrochemistry: Design for a Hermetically Sealed Rotating Disk Electrode Cell. Analytical Chemistry, 89 (1). pp. 581-585. ISSN 0003-2700. doi:10.1021/acs.analchem.6b04228. https://resolver.caltech.edu/CaltechAUTHORS:20161209-102641774

Kim, Youn-Geun and Javier, Alnald and Baricuatro, Jack H. et al. (2017) Seriatim ECSTM-DEMS of Cu-catalyzed reduction of CO in alkaline solution: Operando correlation of electrode-surface atomic structure with product selectivity. Current Topics in Catalysis, 13 . pp. 1-9. ISSN 0972-4508. doi:10.31300/ctct.13.2017.1-9. https://resolver.caltech.edu/CaltechAUTHORS:20190819-125347135

Li, Mufan and Zhao, Zipeng and Cheng, Tao et al. (2016) Ultrafine jagged platinum nanowires enable ultrahigh mass activity for the oxygen reduction reaction. Science, 354 (6318). pp. 1414-1419. ISSN 0036-8075. doi:10.1126/science.aaf9050. https://resolver.caltech.edu/CaltechAUTHORS:20161121-104400912

Beatty, John and Cheng, Tao and Cao, Yuan et al. (2016) Nucleation of Graphene Layers On Magnetic Oxides: Co_3O_4(111) and Cr_2O_3(0001) from Theory and Experiment. Journal of Physical Chemistry Letters, 2017 (8). pp. 188-192. ISSN 1948-7185. doi:10.1021/acs.jpclett.6b02325. https://resolver.caltech.edu/CaltechAUTHORS:20161215-105655858

Liu, Yuanyue and Xiao, Hai and Goddard, William A., III (2016) Schottky-barrier-free contacts with two-dimensional semiconductors by surface-engineered MXenes. Journal of the American Chemical Society, 138 (49). pp. 15853-15856. ISSN 0002-7863. doi:10.1021/jacs.6b10834. https://resolver.caltech.edu/CaltechAUTHORS:20161123-091514649

Fountaine, Katherine T. and Lewerenz, Hans Joachim and Atwater, Harry A. (2016) Efficiency limits for photoelectrochemical water-splitting. Nature Communications, 7 . Art. No. 13706. ISSN 2041-1723. PMCID PMC5146289. doi:10.1038/ncomms13706. https://resolver.caltech.edu/CaltechAUTHORS:20161212-103759501

Lewis, Nathan S. (2016) Developing a scalable artificial photosynthesis technology through nanomaterials by design. Nature Nanotechnology, 11 (12). pp. 1010-1019. ISSN 1748-3387. doi:10.1038/nnano.2016.194. https://resolver.caltech.edu/CaltechAUTHORS:20160805-102228624

Zhou, Jin-Jian and Bernardi, Marco (2016) Ab initio electron mobility and polar phonon scattering in GaAs. Physical Review B, 94 (20). Art. No. 201201(R). ISSN 2469-9950. doi:10.1103/PhysRevB.94.201201. https://resolver.caltech.edu/CaltechAUTHORS:20161128-120519486

Suram, Santosh K. and Newhouse, Paul F. and Gregoire, John M. (2016) High Throughput Light Absorber Discovery, Part 1: An Algorithm for Automated Tauc Analysis. ACS Combinatorial Science, 18 (11). pp. 673-681. ISSN 2156-8952. doi:10.1021/acscombsci.6b00053. https://resolver.caltech.edu/CaltechAUTHORS:20161021-113119506

Suram, Santosh K. and Newhouse, Paul F. and Zhou, Lan et al. (2016) High Throughput Light Absorber Discovery, Part 2: Establishing Structure–Band Gap Energy Relationships. ACS Combinatorial Science, 18 (11). pp. 682-688. ISSN 2156-8952. doi:10.1021/acscombsci.6b00054. https://resolver.caltech.edu/CaltechAUTHORS:20161021-140906751

Kisielowski, C. and Frei, H. and Specht, P. et al. (2016) Detecting structural variances of Co₃O₄ catalysts by controlling beam-induced sample alterations in the vacuum of a transmission electron microscope. Advanced Structural and Chemical Imaging, 2 . Art. No. 13. ISSN 2198-0926. PMCID PMC5093192. doi:10.1186/s40679-016-0027-9. https://resolver.caltech.edu/CaltechAUTHORS:20161109-115755580

Kim, Youn-Geun and Javier, Alnald and Baricuatro, Jack H. et al. (2016) Surface reconstruction of pure-Cu single-crystal electrodes under Co-reduction potentials in alkaline solutions: A study by seriatim ECSTM-DEMS. Journal of Electroanalytical Chemistry, 780 . pp. 290-295. ISSN 1572-6657. doi:10.1016/j.jelechem.2016.09.029. https://resolver.caltech.edu/CaltechAUTHORS:20161010-151601789

Hsiow, Chuen-Yo and Wang, Han-Ying and Lin, Yu-Hsiang et al. (2016) Synthesis and Characterization of Two-Dimensional Conjugated Polymers Incorporating Electron-Deficient Moieties for Application in Organic Photovoltaics. Polymers, 8 (11). Art. No. 382. ISSN 2073-4360. PMCID PMC6432402. doi:10.3390/polym8110382. https://resolver.caltech.edu/CaltechAUTHORS:20170117-084349941

Cheng, Tao and Xiao, Hai and Goddard, William A., III (2016) Reaction Mechanisms for the Electrochemical Reduction of CO_2 to CO and Formate on the Cu(100) Surface at 298 K from Quantum Mechanics Free Energy Calculations with Explicit Water. Journal of the American Chemical Society, 138 (42). pp. 13802-13805. ISSN 0002-7863. doi:10.1021/jacs.6b08534. https://resolver.caltech.edu/CaltechAUTHORS:20161021-102228722

Yalamanchili, Sisir and Emmer, Hal S. and Fountaine, Katherine T. et al. (2016) Enhanced Absorption and <1% Spectrum-and-Angle-Averaged Reflection in Tapered Microwire Arrays. ACS Photonics, 3 (10). pp. 1854-1861. ISSN 2330-4022. doi:10.1021/acsphotonics.6b00370. https://resolver.caltech.edu/CaltechAUTHORS:20161003-084500313

Fountaine, Katherine T. and Cheng, Wen-Hui and Bukowsky, Colton R. et al. (2016) Near-Unity Unselective Absorption in Sparse InP Nanowire Arrays. ACS Photonics, 3 (10). pp. 1826-1832. ISSN 2330-4022. doi:10.1021/acsphotonics.6b00341. https://resolver.caltech.edu/CaltechAUTHORS:20161021-142106782

Zhou, Xinghao and Liu, Rui and Sun, Ke et al. (2016) Solar-Driven Reduction of 1 atm of CO_2 to Formate at 10% Energy-Conversion Efficiency by Use of a TiO_2-Protected III–V Tandem Photoanode in Conjunction with a Bipolar Membrane and a Pd/C Cathode. ACS Energy Letters, 1 (4). pp. 764-770. ISSN 2380-8195. doi:10.1021/acsenergylett.6b00317. https://resolver.caltech.edu/CaltechAUTHORS:20161003-141800305

Xiang, Chengxiang and Weber, Adam Z. and Ardo, Shane et al. (2016) Modeling, Simulation, and Implementation of Solar-Driven Water-Splitting Devices. Angewandte Chemie International Edition, 55 (42). pp. 12974-12988. ISSN 1433-7851. doi:10.1002/anie.201510463. https://resolver.caltech.edu/CaltechAUTHORS:20160729-070531307

Johnson, Samantha I. and Nielsen, Robert J. and Goddard, William A., III (2016) Selectivity for HCO₂^– over H₂ in the Electrochemical Catalytic Reduction of CO₂ by (POCOP)IrH₂. ACS Catalysis, 6 (10). pp. 6362-6371. ISSN 2155-5435. doi:10.1021/acscatal.6b01755. https://resolver.caltech.edu/CaltechAUTHORS:20160902-085020686

Shinde, A. and Li, G. and Zhou, L. et al. (2016) The role of the CeO_2/BiVO_4 interface in optimized Fe-Ce oxide coatings for solar fuels photoanodes. Journal of Materials Chemistry A, 4 (37). pp. 14356-14363. ISSN 2050-7488. doi:10.1039/c6ta04746g. https://resolver.caltech.edu/CaltechAUTHORS:20160909-133249863

Saive, Rebecca and Borsuk, Aleca M. and Emmer, Hal S. et al. (2016) Effectively Transparent Front Contacts for Optoelectronic Devices. Advanced Optical Materials, 4 (10). pp. 1470-1474. ISSN 2195-1071. doi:10.1002/adom.201600252. https://resolver.caltech.edu/CaltechAUTHORS:20160620-101424565

Narang, Prineha and Sundararaman, Ravishankar and Jermyn, Adam S. et al. (2016) Cubic Nonlinearity Driven Up-Conversion in High-Field Plasmonic Hot Carrier Systems. Journal of Physical Chemistry C, 120 (37). pp. 21056-21062. ISSN 1932-7447. doi:10.1021/acs.jpcc.6b03463. https://resolver.caltech.edu/CaltechAUTHORS:20160718-092335284

Shinde, Aniketa and Guevarra, Dan and Liu, Guiji et al. (2016) Discovery of Fe–Ce Oxide/BiVO₄ Photoanodes through Combinatorial Exploration of Ni–Fe–Co–Ce Oxide Coatings. ACS Applied Materials & Interfaces, 8 (36). pp. 23696-23705. ISSN 1944-8244. doi:10.1021/acsami.6b06714. https://resolver.caltech.edu/CaltechAUTHORS:20160907-090003256

Huang, Yao-Wei and Lee, Ho Wai Howard and Sokhoyan, Ruzan et al. (2016) Gate-Tunable Conducting Oxide Metasurfaces. Nano Letters, 16 (9). pp. 5319-5325. ISSN 1530-6984. doi:10.1021/acs.nanolett.6b00555. https://resolver.caltech.edu/CaltechAUTHORS:20160907-142523365

Wang, Ruirui and Pan, Kecheng and Han, Dandan et al. (2016) Solar-Driven H_2O_2 Generation From H_2O and O_2 Using Earth-Abundant Mixed-Metal Oxide@Carbon Nitride Photocatalysts. ChemSusChem, 9 (17). pp. 2470-2479. ISSN 1864-5631. doi:10.1002/cssc.201600705. https://resolver.caltech.edu/CaltechAUTHORS:20161128-081718603

Lewerenz, Hans-Joachim and Lichterman, Michael F. and Richter, Matthias H. et al. (2016) Operando Analyses of Solar Fuels Light Absorbers and Catalysts. Electrochimica Acta, 211 . pp. 711-719. ISSN 0013-4686. doi:10.1016/j.electacta.2016.06.006. https://resolver.caltech.edu/CaltechAUTHORS:20160629-130400375

Kim, Youn-Geun and Javier, Alnald and Baricuatro, Jack H. et al. (2016) Regulating the Product Distribution of CO Reduction by the Atomic-Level Structural Modification of the Cu Electrode Surface. Electrocatalysis, 7 (5). pp. 391-399. ISSN 1868-2529. doi:10.1007/s12678-016-0314-1. https://resolver.caltech.edu/CaltechAUTHORS:20160620-134104006

Brown, Ana M. and Sundararaman, Ravishankar and Narang, Prineha et al. (2016) Ab initio phonon coupling and optical response of hot electrons in plasmonic metals. Physical Review B, 94 (7). Art. No. 075120. ISSN 2469-9950. doi:10.1103/PhysRevB.94.075120. https://resolver.caltech.edu/CaltechAUTHORS:20160613-140325024

Baricuatro, Jack H. and Saadi, Fadl H. and Carim, Azhar I. et al. (2016) Influence of Redox-Inactive Cations on the Structure and Electrochemical Reactivity of Synthetic Birnessite, a Heterogeneous Analog for the Oxygen-Evolving Complex. Journal of Physical Chemistry C, 120 (29). pp. 15618-15631. ISSN 1932-7447. doi:10.1021/acs.jpcc.5b07028. https://resolver.caltech.edu/CaltechAUTHORS:20151005-112626822

Sieh, Daniel and Kubiak, Clifford P. (2016) A Series of Diamagnetic Pyridine Monoimine Rhenium Complexes with Different Degrees of Metal-to-Ligand Charge Transfer: Correlating ^(13)C NMR Chemical Shifts with Bond Lengths in Redox-Active Ligands. Chemistry: a European Journal, 22 (30). pp. 10638-10650. ISSN 0947-6539. doi:10.1002/chem.201600679. https://resolver.caltech.edu/CaltechAUTHORS:20160627-120321347

Kiriya, Daisuke and Lobaccaro, Peter and Nyein, Hnin Yin Yin et al. (2016) General Thermal Texturization Process of MoS_2 for Efficient Electrocatalytic Hydrogen Evolution Reaction. Nano Letters, 16 (7). pp. 4047-4053. ISSN 1530-6984. doi:10.1021/acs.nanolett.6b00569. https://resolver.caltech.edu/CaltechAUTHORS:20170922-093800265

Cheng, Chuyang and Cheng, Tao and Xiao, Hai et al. (2016) Influence of Constitution and Charge on Radical Pairing Interactions in Tris-radical Tricationic Complexes. Journal of the American Chemical Society, 138 (26). pp. 8288-8300. ISSN 0002-7863. doi:10.1021/jacs.6b04343. https://resolver.caltech.edu/CaltechAUTHORS:20160610-073334314

Sun, Ke and Liu, Rui and Chen, Yikai et al. (2016) A Stabilized, Intrinsically Safe, 10% Efficient, Solar-Driven Water-Splitting Cell Incorporating Earth-Abundant Electrocatalysts with Steady-State pH Gradients and Product Separation Enabled by a Bipolar Membrane. Advanced Energy Materials, 6 (13). Art. No. 1600379. ISSN 1614-6832. doi:10.1002/aenm.201600379. https://resolver.caltech.edu/CaltechAUTHORS:20160502-135457387

Toma, Francesca M. and Cooper, Jason K. and Kunzelmann, Viktoria et al. (2016) Mechanistic insights into chemical and photochemical transformations of bismuth vanadate photoanodes. Nature Communications, 7 . Art. No. 12012. ISSN 2041-1723. PMCID PMC4935965. doi:10.1038/ncomms12012. https://resolver.caltech.edu/CaltechAUTHORS:20160718-095141596

Lewis, Nathan S. (2016) Aspects of science and technology in support of legal and policy frameworks associated with a global carbon emissions-control regime. Energy and Environmental Science, 9 (7). pp. 2172-2176. ISSN 1754-5692. doi:10.1039/c6ee00272b. https://resolver.caltech.edu/CaltechAUTHORS:20160627-113518244

Shaner, Matthew R. and Atwater, Harry A. and Lewis, Nathan S. et al. (2016) A comparative technoeconomic analysis of renewable hydrogen production using solar energy. Energy and Environmental Science, 9 (7). pp. 2354-2371. ISSN 1754-5692. doi:10.1039/c5ee02573g. https://resolver.caltech.edu/CaltechAUTHORS:20160610-132918453

Bernardi, Marco and Grossman, Jeffrey C. (2016) Computer calculations across time and length scales in photovoltaic solar cells. Energy and Environmental Science, 9 (7). pp. 2197-2218. ISSN 1754-5692. doi:10.1039/C6EE01010E. https://resolver.caltech.edu/CaltechAUTHORS:20160629-122500821

Yang, Xiaogang and Liu, Rui and Lei, Yan et al. (2016) Dual Influence of Reduction Annealing on Diffused Hematite/FTO Junction for Enhanced Photoelectrochemical Water Oxidation. ACS Applied Materials & Interfaces, 8 (25). pp. 16476-16485. ISSN 1944-8244. doi:10.1021/acsami.6b04213. https://resolver.caltech.edu/CaltechAUTHORS:20160629-132009561

Schwarz, Kathleen and Xu, Bingjun and Yan, Yushan et al. (2016) Partial oxidation of step-bound water leads to anomalous pH effects on metal electrode step-edges. Physical Chemistry Chemical Physics, 18 (24). pp. 16216-16223. ISSN 1463-9076. doi:10.1039/c6cp01652a. https://resolver.caltech.edu/CaltechAUTHORS:20160610-140536521

Chen, Yikai and Lewis, Nathan S. and Xiang, Chengxiang (2016) Modeling and Simulation of the Spatial and Light-Intensity Dependence of Product Distributions in an Integrated Photoelectrochemical CO_2 Reduction System. ACS Energy Letters, 2016 (1). pp. 273-280. ISSN 2380-8195. doi:10.1021/acsenergylett.6b00134. https://resolver.caltech.edu/CaltechAUTHORS:20160627-135527397

Narang, Prineha and Sundararaman, Ravishankar and Atwater, Harry A. (2016) Plasmonic hot carrier dynamics in solid-state and chemical systems for energy conversion. Nanophotonics, 5 (1). pp. 96-111. ISSN 2192-8606. doi:10.1515/nanoph-2016-0007. https://resolver.caltech.edu/CaltechAUTHORS:20160627-104035060

Azarpia, Anahita and Schedel-Niedrig, Thomas and Lewerenz, H.-J. et al. (2016) Sustained Water Oxidation by Direct Electrosynthesis of Ultrathin Organic Protection Films on Silicon. Advanced Energy Materials, 6 (10). p. 1502314. ISSN 1614-6832. doi:10.1002/aenm.201502314. https://resolver.caltech.edu/CaltechAUTHORS:20160629-084424702

Jiang, Shaojie and Fang, Yanan and Li, Ruipeng et al. (2016) Pressure-Dependent Polymorphism and Band-Gap Tuning of Methylammonium Lead Iodide Perovskite. Angewandte Chemie International Edition, 55 (22). pp. 6540-6544. ISSN 1433-7851. doi:10.1002/anie.201601788. https://resolver.caltech.edu/CaltechAUTHORS:20160427-103659758

Newhouse, P. F. and Boyd, D. A. and Shinde, A. et al. (2016) Solar fuel photoanodes prepared by inkjet printing of copper vanadates. Journal of Materials Chemistry A, 4 (19). pp. 7483-7494. ISSN 2050-7488. doi:10.1039/C6TA01252C. https://resolver.caltech.edu/CaltechAUTHORS:20160502-100311001

Liu, Yuanyue and Xiao, Hai and Goddard, William A., III (2016) Two-Dimensional Halide Perovskites: Tuning Electronic Activities of Defects. Nano Letters, 16 (5). pp. 3335-3340. ISSN 1530-6984. doi:10.1021/acs.nanolett.6b00964. https://resolver.caltech.edu/CaltechAUTHORS:20160428-094924238

Xiang, Chengxiang and Papadantonakis, Kimberly M. and Lewis, Nathan S. (2016) Principles and implementations of electrolysis systems for water splitting. Materials Horizons, 2016 (3). pp. 169-173. ISSN 2051-6347. doi:10.1039/c6mh00016a. https://resolver.caltech.edu/CaltechAUTHORS:20160307-084720706

Hattrick-Simpers, Jason R. and Gregoire, John M. and Kusne, A. Gilad (2016) Perspective: Composition–structure–property mapping in high-throughput experiments: Turning data into knowledge. APL Materials, 4 (5). Art. No. 053211. ISSN 2166-532X. doi:10.1063/1.4950995. https://resolver.caltech.edu/CaltechAUTHORS:20160616-071550684

Zhou, Lan and Yan, Qimin and Yu, Jie et al. (2016) Stability and self-passivation of copper vanadate photoanodes under chemical, electrochemical, and photoelectrochemical operation. Physical Chemistry Chemical Physics, 18 (14). pp. 9349-9352. ISSN 1463-9076. doi:10.1039/C6CP00473C. https://resolver.caltech.edu/CaltechAUTHORS:20160323-102320816

Zhou, Xinghao and Liu, Rui and Sun, Ke et al. (2016) 570 mV photovoltage, stabilized n-Si/CoO_x heterojunction photoanodes fabricated using atomic layer deposition. Energy and Environmental Science, 9 (3). pp. 892-897. ISSN 1754-5692. doi:10.1039/C5EE03655K. https://resolver.caltech.edu/CaltechAUTHORS:20160202-092151363

Tolstova, Yulia and Omelchenko, Stefan T. and Shing, Amanda M. et al. (2016) Heteroepitaxial growth of Pt and Au thin films on MgO single crystals by bias-assisted sputtering. Scientific Reports, 6 . Art. No. 23232. ISSN 2045-2322. PMCID PMC4794713. doi:10.1038/srep23232. https://resolver.caltech.edu/CaltechAUTHORS:20160323-130316195

Azhagurajan, Mukkannan and Kajita, Tetsuya and Itoh, Takashi et al. (2016) In Situ Visualization of Lithium Ion Intercalation into MoS_2 Single Crystals using Differential Optical Microscopy with Atomic Layer Resolution. Journal of the American Chemical Society, 138 (10). pp. 3355-3361. ISSN 0002-7863. doi:10.1021/jacs.5b11849. https://resolver.caltech.edu/CaltechAUTHORS:20160321-081806933

Lichterman, Michael F. and Sun, Ke and Hu, Shu et al. (2016) Protection of inorganic semiconductors for sustained, efficient photoelectrochemical water oxidation. Catalysis Today, 262 . pp. 11-23. ISSN 0920-5861. doi:10.1016/j.cattod.2015.08.017. https://resolver.caltech.edu/CaltechAUTHORS:20151106-151700406

Meng, Xiangying and Wang, Lu and Liu, Dongyan et al. (2016) Discovery of Fe_2 =P-Type Ti(Zr/Hf)_2O_6 Photocatalysts toward Water Splitting. Chemistry of Materials, 28 (5). pp. 1335-1342. ISSN 0897-4756. doi:10.1021/acs.chemmater.5b04256. https://resolver.caltech.edu/CaltechAUTHORS:20160401-073356309

Torelli, Daniel A. and Francis, Sonja A. and Crompton, J. Chance et al. (2016) Nickel−Gallium-Catalyzed Electrochemical Reduction of CO_2 to Highly Reduced Products at Low Overpotentials. ACS Catalysis, 6 (3). pp. 2100-2104. ISSN 2155-5435. doi:10.1021/acscatal.5b02888. https://resolver.caltech.edu/CaltechAUTHORS:20160224-132719916

Crowley, Jason M. and Tahir-Kheli, Jamil and Goddard, William A., III (2016) Resolution of the Band Gap Prediction Problem for Materials Design. Journal of Physical Chemistry Letters, 2016 (7). pp. 1198-1203. ISSN 1948-7185. doi:10.1021/acs.jpclett.5b02870. https://resolver.caltech.edu/CaltechAUTHORS:20160321-091914241

Jung, Suho and McCrory, Charles C. L. and Ferrer, Ivonne M. et al. (2016) Benchmarking nanoparticulate metal oxide electrocatalysts for the alkaline water oxidation reaction. Journal of Materials Chemistry A, 4 (8). pp. 3068-3076. ISSN 2050-7488. doi:10.1039/c5ta07586f. https://resolver.caltech.edu/CaltechAUTHORS:20151215-102451419

Hu, Shu and Richter, Matthias H. and Lichterman, Michael F. et al. (2016) Electrical, Photoelectrochemical, and Photoelectron Spectroscopic Investigation of the Interfacial Transport and Energetics of Amorphous TiO₂/Si Heterojunctions. Journal of Physical Chemistry C, 120 (6). pp. 3117-3129. ISSN 1932-7447. doi:10.1021/acs.jpcc.5b09121. https://resolver.caltech.edu/CaltechAUTHORS:20160202-092151875

Guevarra, D. and Shinde, A. and Suram, S. K. et al. (2016) Development of solar fuels photoanodes through combinatorial integration of Ni–La–Co–Ce oxide catalysts on BiVO₄. Energy and Environmental Science, 9 (2). pp. 565-580. ISSN 1754-5692. doi:10.1039/c5ee03488d. https://resolver.caltech.edu/CaltechAUTHORS:20151221-160606238

Lewis, Nathan S. (2016) Research opportunities to advance solar energy utilization. Science, 351 (6271). Art. No. aad1920. ISSN 0036-8075. doi:10.1126/science.aad1920. https://resolver.caltech.edu/CaltechAUTHORS:20160122-095830294

Xiao, Hai and Cheng, Tao and Goddard, William A., III et al. (2016) Mechanistic Explanation of the pH Dependence and Onset Potentials for Hydrocarbon Products from Electrochemical Reduction of CO on Cu (111). Journal of the American Chemical Society, 138 (2). pp. 483-486. ISSN 0002-7863. doi:10.1021/jacs.5b11390. https://resolver.caltech.edu/CaltechAUTHORS:20160111-095847659

Velazquez, Jesus M. and John, Jimmy and Esposito, Daniel V. et al. (2016) A scanning probe investigation of the role of surface motifs in the behavior of p-WSe_2 photocathodes. Energy and Environmental Science, 9 (1). pp. 164-175. ISSN 1754-5692. doi:10.1039/C5EE02530C. https://resolver.caltech.edu/CaltechAUTHORS:20151109-102020642

Brown, Ana M. and Sundararaman, Ravishankar and Narang, Prineha et al. (2016) Nonradiative Plasmon Decay and Hot Carrier Dynamics: Effects of Phonons, Surfaces, and Geometry. ACS Nano, 10 (1). pp. 957-966. ISSN 1936-0851. doi:10.1021/acsnano.5b06199. https://resolver.caltech.edu/CaltechAUTHORS:20160104-150344444

Lichterman, Michael F. and Richter, Matthias H. and Hu, Shu et al. (2016) An Electrochemical, Microtopographical and Ambient Pressure X-Ray Photoelectron Spectroscopic Investigation of Si/TiO_2/Ni/Electrolyte Interfaces. Journal of the Electrochemical Society, 163 (2). H139-H146. ISSN 0013-4651. doi:10.1149/2.0861602jes. https://resolver.caltech.edu/CaltechAUTHORS:20151215-152721755

Shaner, Matthew R. and McDowell, Matthew T. and Pien, Alex et al. (2016) Si/TiO_2 Tandem-Junction Microwire Arrays for Unassisted Solar-Driven Water Splitting. Journal of the Electrochemical Society, 163 (5). H261-H264. ISSN 0013-4651. doi:10.1149/2.0141605jes. https://resolver.caltech.edu/CaltechAUTHORS:20160301-075443518

Ping, Yuan and Sundararaman, Ravishankar and Goddard, William A., III (2015) Solvation effects on the band edge positions of photocatalysts from first principles. Physical Chemistry Chemical Physics, 17 (45). pp. 30499-30509. ISSN 1463-9076. doi:10.1039/c5cp05740j. https://resolver.caltech.edu/CaltechAUTHORS:20151103-075722264

Cheng, Tao and Xiao, Hai and Goddard, William A., III (2015) Free-Energy Barriers and Reaction Mechanisms for the Electrochemical Reduction of CO on the Cu(100) Surface, Including Multiple Layers of Explicit Solvent at pH 0. Journal of Physical Chemistry Letters, 6 (23). pp. 4767-4773. ISSN 1948-7185. doi:10.1021/acs.jpclett.5b02247. https://resolver.caltech.edu/CaltechAUTHORS:20151123-110728006

Huang, Zhuangqun and Jiang, Jingjing and Hua, Yueming et al. (2015) Atomic Force Microscopy for Solar Fuels Research: An Introductory Review. Energy and Environment Focus, 4 (4). pp. 260-277. ISSN 2326-3040. doi:10.1166/eef.2015.1180. https://resolver.caltech.edu/CaltechAUTHORS:20151209-134832901

Gethers, Matthew L. and Thomas, John C. and Jiang, Shan et al. (2015) Holey Graphene as a Weed Barrier for Molecules. ACS Nano, 9 (11). pp. 10909-10915. ISSN 1936-0851. doi:10.1021/acsnano.5b03936. https://resolver.caltech.edu/CaltechAUTHORS:20151012-132204304

Zhou, Lan and Yan, Qimin and Shinde, Aniketa et al. (2015) High Throughput Discovery of Solar Fuels Photoanodes in the CuO-V_2O_5 System. Advanced Energy Materials, 5 (22). Art. No. 1500968. ISSN 1614-6832. doi:10.1002/aenm.201500968. https://resolver.caltech.edu/CaltechAUTHORS:20150902-125617374

Verlage, Erik and Hu, Shu and Liu, Rui et al. (2015) A Monolithically Integrated, Intrinsically Safe, 10% Efficient, Solar-Driven Water-Splitting System Based on Active, Stable Earth-Abundant Electrocatalysts in Conjunction with Tandem III-V Light Absorbers Protected by Amorphous TiO_2 Films. Energy and Environmental Science, 8 (11). pp. 3166-3172. ISSN 1754-5692. doi:10.1039/C5EE01786F. https://resolver.caltech.edu/CaltechAUTHORS:20150825-164619530

Fenwick, Aidan Q. and Gregoire, John M. and Luca, Oana R. (2015) Electrocatalytic Reduction of Nitrogen and Carbon Dioxide to Chemical Fuels: Challenges and Opportunities for a Solar Fuel Device. Journal of Photochemistry and Photobiology B: Biology, 152 . pp. 47-57. ISSN 1011-1344. doi:10.1016/j.jphotobiol.2014.12.019. https://resolver.caltech.edu/CaltechAUTHORS:20160104-105432412

Fenwick, Aidan Q. and Luca, Oana R. (2015) The Formation of CO by Thermal Decomposition of Formic Acid under Electrochemical Conditions of CO_2 Reduction. Journal of Photochemistry and Photobiology B: Biology, 152 . pp. 43-46. ISSN 1011-1344. doi:10.1016/j.jphotobiol.2015.04.003. https://resolver.caltech.edu/CaltechAUTHORS:20150505-082908999

Javier, Alnald and Baricuatro, Jack H. and Kim, Youn-Geun et al. (2015) Overlayer Au-on-W Near-Surface Alloy for the Selective Electrochemical Reduction of CO_2 to Methanol: Empirical (DEMS) Corroboration of a Computational (DFT) Prediction. Electrocatalysis, 6 (6). pp. 493-497. ISSN 1868-2529. doi:10.1007/s12678-015-0276-8. https://resolver.caltech.edu/CaltechAUTHORS:20150831-084011671

Hu, Shu and Lewis, Nathan S. and Ager, Joel W. et al. (2015) Thin-Film Materials for the Protection of Semiconducting Photoelectrodes in Solar-Fuel Generators. Journal of Physical Chemistry C, 119 (43). pp. 24201-24228. ISSN 1932-7447. doi:10.1021/acs.jpcc.5b05976. https://resolver.caltech.edu/CaltechAUTHORS:20151027-111752059

Zhou, Lan and Suram, Santosh K. and Becerra-Stasiewicz, Natalie et al. (2015) Combining reactive sputtering and rapid thermal processing for synthesis and discovery of metal oxynitrides. Journal of Materials Research, 30 (19). pp. 2928-2933. ISSN 0884-2914. doi:10.1557/jmr.2015.140. https://resolver.caltech.edu/CaltechAUTHORS:20151019-090734492

Ager, Joel W. and Shaner, Matthew R. and Walczak, Karl A. et al. (2015) Experimental demonstrations of spontaneous, solar-driven photoelectrochemical water splitting. Energy and Environmental Science, 8 (10). pp. 2811-2824. ISSN 1754-5692. doi:10.1039/c5ee00457h. https://resolver.caltech.edu/CaltechAUTHORS:20151029-125838701

Shaner, Matthew R. and McKone, James R. and Gray, Harry B. et al. (2015) Functional integration of Ni–Mo electrocatalysts with Si microwire array photocathodes to simultaneously achieve high fill factors and light-limited photocurrent densities for solar-driven hydrogen evolution. Energy and Environmental Science, 8 (10). pp. 2977-2984. ISSN 1754-5692. doi:10.1039/C5EE01076D. https://resolver.caltech.edu/CaltechAUTHORS:20150814-170845573

Fabian, David M. and Hu, Shu and Singh, Nirala et al. (2015) Particle suspension reactors and materials for solar-driven water splitting. Energy and Environmental Science, 8 (10). pp. 2825-2850. ISSN 1754-5692. doi:10.1039/C5EE01434D. https://resolver.caltech.edu/CaltechAUTHORS:20151030-125812115

Suseno, Sandy and McCrory, Charles C. L. and Tran, Rosalie et al. (2015) Molecular Mixed-Metal Manganese Oxido Cubanes as Precursors to Heterogeneous Oxygen Evolution Catalysts. Chemistry: a European Journal, 21 (38). pp. 13420-13430. ISSN 0947-6539. PMCID PMC4868073. doi:10.1002/chem.201501104. https://resolver.caltech.edu/CaltechAUTHORS:20150810-085304566

Zhou, Xinghao and Liu, Rui and Sun, Ke et al. (2015) Interface engineering of the photoelectrochemical performance of Ni-oxide-coated n-Si photoanodes by atomic-layer deposition of ultrathin films of cobalt oxide. Energy and Environmental Science, 8 (9). pp. 2644-2649. ISSN 1754-5692. doi:10.1039/c5ee01687h. https://resolver.caltech.edu/CaltechAUTHORS:20150804-104946656

Singh, Meenesh R. and Papadantonakis, Kimberly M. and Xiang, Chengxiang et al. (2015) An electrochemical engineering assessment of the operational conditions and constraints for solar-driven water-splitting systems at near-neutral pH. Energy and Environmental Science, 8 (9). pp. 2760-2767. ISSN 1754-5692. doi:10.1039/c5ee01721a. https://resolver.caltech.edu/CaltechAUTHORS:20150918-153945062

May, Matthias M. and Lewerenz, Hans-Joachim and Lackner, David et al. (2015) Efficient direct solar-to-hydrogen conversion by in situ interface transformation of a tandem structure. Nature Communications, 6 (9). Art. No. 8286. ISSN 2041-1723. PMCID PMC4579846. doi:10.1038/ncomms9286. https://resolver.caltech.edu/CaltechAUTHORS:20151105-084800992

Plymale, Noah T. and Kim, Youn-Geun and Soriaga, Manuel P. et al. (2015) Synthesis, Characterization, and Reactivity of Ethynyl- and Propynyl-Terminated Si(111) Surfaces. Journal of Physical Chemistry C, 119 (34). pp. 19847-19862. ISSN 1932-7447. doi:10.1021/acs.jpcc.5b05028. https://resolver.caltech.edu/CaltechAUTHORS:20150825-113614153

Lichterman, Michael F. and Hu, Shu and Richter, Matthias H. et al. (2015) Direct observation of the energetics at a semiconductor/liquid junction by operando X-ray photoelectron spectroscopy. Energy and Environmental Science, 8 (8). pp. 2409-2416. ISSN 1754-5692. doi:10.1039/C5EE01014D. https://resolver.caltech.edu/CaltechAUTHORS:20150706-104957791

McDowell, Matthew T. and Lichterman, Michael F. and Carim, Azhar I. et al. (2015) The Influence of Structure and Processing on the Behavior of TiO_2 Protective Layers for Stabilization of n-Si/TiO_2/Ni Photoanodes for Water Oxidation. ACS Applied Materials & Interfaces, 7 (28). pp. 15189-15199. ISSN 1944-8244. doi:10.1021/acsami.5b00379. https://resolver.caltech.edu/CaltechAUTHORS:20150715-142850363

Wong, Keith T. and Kim, Youn-Geun and Soriaga, Manuel P. et al. (2015) Synthesis and Characterization of Atomically Flat Methyl-Terminated Ge(111) Surfaces. Journal of the American Chemical Society, 137 (28). pp. 9006-9014. ISSN 0002-7863. doi:10.1021/jacs.5b03339. https://resolver.caltech.edu/CaltechAUTHORS:20150714-134139272

Lewis, Nathan S. and Nocera, Daniel G. (2015) The solar opportunity. The Bridge, 45 (2). pp. 41-47. ISSN 0737-6278. https://resolver.caltech.edu/CaltechAUTHORS:20160616-173850450

Liu, Rui and Han, Lihao and Huang, Zhuangqun et al. (2015) A low-temperature synthesis of electrochemical active Pt nanoparticles and thin films by atomic layer deposition on Si(111) and glassy carbon surfaces. Thin Solid Films, 586 . pp. 28-34. ISSN 0040-6090. doi:10.1016/j.tsf.2015.04.018. https://resolver.caltech.edu/CaltechAUTHORS:20150504-140234191

Kuang, Yanjin and Sun, Ke and Sukrittanon, Supanee et al. (2015) Enhancement of the performance of GaP solar cells by embedded In(N)P quantum dots. Nano Energy, 15 . pp. 782-788. ISSN 2211-2855. doi:10.1016/j.nanoen.2015.06.003. https://resolver.caltech.edu/CaltechAUTHORS:20151204-091530978

Liu, Rui and Stephani, Carolynn and Tan, Kian L. et al. (2015) Tuning redox potentials of CO_2 reduction catalysts for carbon photofixation by Si nanowires. Science China Materials, 58 (7). pp. 515-520. ISSN 2095-8226. doi:10.1007/s40843-015-0068-8. https://resolver.caltech.edu/CaltechAUTHORS:20151209-135417487

Sun, Ke and Kuang, Yanjin and Verlage, Erik et al. (2015) Sputtered NiO_x Films for Stabilization of p^+n-lnP Photoanodes for Solar-Driven Water Oxidation. Advanced Energy Materials, 5 (11). Art. No. 1402276. ISSN 1614-6832. doi:10.1002/aenm.201402276. https://resolver.caltech.edu/CaltechAUTHORS:20150608-142332412

Sieh, Daniel and Lacy, David C. and Peters, Jonas C. et al. (2015) Reduction of CO₂ by Pyridine Monoimine Molybdenum Carbonyl Complexes: Cooperative Metal–Ligand Binding of CO₂. Chemistry: a European Journal, 21 (23). pp. 8497-8503. ISSN 0947-6539. PMCID PMC4523092. doi:10.1002/chem.201500463. https://resolver.caltech.edu/CaltechAUTHORS:20150504-095804337

Chen, Yikai and Sun, Ke and Audesirk, Heather A. et al. (2015) A quantitative analysis of the efficiency of solar-driven water-splitting device designs based on tandem photoabsorbers patterned with islands of metallic electrocatalysts. Energy and Environmental Science, 8 (6). pp. 1736-1747. ISSN 1754-5692. doi:10.1039/c5ee00311c. https://resolver.caltech.edu/CaltechAUTHORS:20150427-134904440

Huang, Yufeng and Nielsen, Robert J. and Goddard, William A., III et al. (2015) The Reaction Mechanism with Free Energy Barriers for Electrochemical Dihydrogen Evolution on MoS_2. Journal of the American Chemical Society, 137 (20). pp. 6692-6698. ISSN 0002-7863. doi:10.1021/jacs.5b03329. https://resolver.caltech.edu/CaltechAUTHORS:20150518-142900035

Haber, Joel A. and Anzenburg, Eitan and Yano, Junko et al. (2015) Multiphase Nanostructure of a Quinary Metal Oxide Electrocatalyst Reveals a New Direction for OER Electrocatalyst Design. Advanced Energy Materials, 5 (10). Art. No. 1402307. ISSN 1614-6832. doi:10.1002/aenm.201402307. https://resolver.caltech.edu/CaltechAUTHORS:20150615-085042878

Ledina, M. A. and Liang, X. and Kim, Y.-G. et al. (2015) Investigations into the Formation of Germanene Using Electrochemical Atomic Layer Deposition (E-ALD). ECS Transactions, 66 (6). pp. 129-140. ISSN 1938-6737. doi:10.1149/06606.0129ecst. https://resolver.caltech.edu/CaltechAUTHORS:20180914-100810994

Lichterman, Michael Frankston and Richter, Matthias Hermann and Hu, Shu et al. (2015) Investigation of the Si/TiO_2/Electrolyte Interface Using Operando Tender X-ray Photoelectron Spectroscopy. ECS Transactions, 66 (6). pp. 97-103. ISSN 1938-6737. doi:10.1149/06606.0097ecst. https://resolver.caltech.edu/CaltechAUTHORS:20161121-082816017

Richter, Matthias Hermann and Lichterman, Michael Frankston and Hu, Shu et al. (2015) Measurement of the Energy-Band Relations of Stabilized Si Photoanodes Using Operando Ambient Pressure X-ray Photoelectron Spectroscopy. ECS Transactions, 66 (6). pp. 105-113. ISSN 1938-6737. doi:10.1149/06606.0105ecst. https://resolver.caltech.edu/CaltechAUTHORS:20161121-083409878

Ardo, Shane and Park, Sang Hee and Warren, Emily L. et al. (2015) Unassisted solar-driven photoelectrosynthetic HI splitting using membrane-embedded Si microwire arrays. Energy and Environmental Science, 8 (5). pp. 1484-1492. ISSN 1754-5692. doi:10.1039/c5ee00227c. https://resolver.caltech.edu/CaltechAUTHORS:20150427-090213779

Yan, Qimin and Li, Guo and Newhouse, Paul F. et al. (2015) Mn_2V_2O_7: An Earth Abundant Light Absorber for Solar Water Splitting. Advanced Energy Materials, 5 (8). Art. No. 1401840 . ISSN 1614-6832. doi:10.1002/aenm.201401840. https://resolver.caltech.edu/CaltechAUTHORS:20150519-092604842

Luca, Oana R. and McCrory, Charles C. L. and Dalleska, Nathan F. et al. (2015) The Selective Electrochemical Conversion of Preactivated CO_2 to Methane. Journal of the Electrochemical Society, 162 (7). H473-H476. ISSN 0013-4651. doi:10.1149/2.0371507jes. https://resolver.caltech.edu/CaltechAUTHORS:20150622-081748039

McCrory, Charles C. L. and Jung, Suho and Ferrer, Ivonne M. et al. (2015) Benchmarking Hydrogen Evolving Reaction and Oxygen Evolving Reaction Electrocatalysts for Solar Water Splitting Devices. Journal of the American Chemical Society, 137 (13). pp. 4347-4357. ISSN 0002-7863. doi:10.1021/ja510442p. https://resolver.caltech.edu/CaltechAUTHORS:20150331-092334778

Suram, Santosh K. and Haber, Joel A. and Jin, Jian et al. (2015) Generating Information-Rich High-Throughput Experimental Materials Genomes using Functional Clustering via Multitree Genetic Programming and Information Theory. ACS Combinatorial Science, 17 (4). pp. 224-233. ISSN 2156-8952. doi:10.1021/co5001579. https://resolver.caltech.edu/CaltechAUTHORS:20150309-091323359

Niu, Kai-Yang and Lin, Feng and Jung, Suho et al. (2015) Tuning Complex Transition Metal Hydroxide Nanostructures as Active Catalysts for Water Oxidation by a Laser−Chemical Route. Nano Letters, 15 (4). pp. 2498-2503. ISSN 1530-6984. doi:10.1021/acs.nanolett.5b00026. https://resolver.caltech.edu/CaltechAUTHORS:20150508-071809496

Sun, Ke and Saadi, Fadl H. and Lichterman, Michael F. et al. (2015) Stable solar-driven oxidation of water by semiconducting photoanodes protected by transparent catalytic nickel oxide films. Proceedings of the National Academy of Sciences of the United States of America, 112 (12). pp. 3612-3617. ISSN 0027-8424. PMCID PMC4378389. doi:10.1073/pnas.1423034112. https://resolver.caltech.edu/CaltechAUTHORS:20150311-121532251

Chen, Yikai and Hu, Shu and Xiang, Chengxiang et al. (2015) A sensitivity analysis to assess the relative importance of improvements in electrocatalysts, light absorbers, and system geometry on the efficiency of solar-fuels generators. Energy and Environmental Science, 8 (3). pp. 876-886. ISSN 1754-5692. doi:10.1039/c4ee02314e. https://resolver.caltech.edu/CaltechAUTHORS:20150430-084157336

Mitrovic, Slobodan and Soedarmadji, Edwin and Newhouse, Paul F. et al. (2015) Colorimetric Screening for High-Throughput Discovery of Light Absorbers. ACS Combinatorial Science, 17 (3). pp. 176-181. ISSN 2156-8952. doi:10.1021/co500151u. https://resolver.caltech.edu/CaltechAUTHORS:20150120-090415724

Suram, Santosh K. and Zhou, Lan and Becerra-Stasiewicz, Natalie et al. (2015) Combinatorial thin film composition mapping using three dimensional deposition profiles. Review of Scientific Instruments, 86 (3). Art. No. 033904. ISSN 0034-6748. doi:10.1063/1.4914466. https://resolver.caltech.edu/CaltechAUTHORS:20150323-110035126

Javier, Alnald and Chmielowiec, Brian and Sanabria-Chinchilla, Jean et al. (2015) A DEMS Study of the Reduction of CO_2, CO, and HCHO Pre-Adsorbed on Cu Electrodes: Empirical Inferences on the CO_2RR Mechanism. Electrocatalysis, 6 (2). pp. 127-131. ISSN 1868-2529. doi:10.1007/s12678-015-0246-1. https://resolver.caltech.edu/CaltechAUTHORS:20150202-141003348

Shinde, Aniketa and Jones, Ryan J. R. and Guevarra, Dan et al. (2015) High-Throughput Screening for Acid-Stable Oxygen Evolution Electrocatalysts in the (Mn–Co–Ta–Sb)O_x Composition Space. Electrocatalysis, 6 (2). pp. 229-236. ISSN 1868-2529. doi:10.1007/s12678-014-0237-7. https://resolver.caltech.edu/CaltechAUTHORS:20141117-094914554

Han, Lihao and Digdaya, Ibadillah A. and Buijs, Thom W. F. et al. (2015) Gradient dopant profiling and spectral utilization of monolithic thin-film silicon photoelectrochemical tandem devices for solar water splitting. Journal of Materials Chemistry A, 3 (8). pp. 4155-4162. ISSN 2050-7488. doi:10.1039/C4TA05523C. https://resolver.caltech.edu/CaltechAUTHORS:20150324-151230776

Sun, Ke and McDowell, Matthew T. and Nielander, Adam C. et al. (2015) Stable Solar-Driven Water Oxidation to O_2(g) by Ni-Oxide-Coated Silicon Photoanodes. Journal of Physical Chemistry Letters, 6 (4). pp. 592-598. ISSN 1948-7185. doi:10.1021/jz5026195. https://resolver.caltech.edu/CaltechAUTHORS:20150202-095259720

Shinde, Aniketa and Guevarra, Dan and Haber, Joel A. et al. (2015) Identification of optimal solar fuel electrocatalysts via high throughput in situ optical measurements. Journal of Materials Research, 30 (3). pp. 442-450. ISSN 0884-2914. doi:10.1557/jmr.2014.296. https://resolver.caltech.edu/CaltechAUTHORS:20150327-092659678

Sundararaman, Ravishankar and Goddard, William A., III (2015) The charge-asymmetric nonlocally determined local-electric (CANDLE) solvation model. Journal of Chemical Physics, 142 (6). Art. No. 064107. ISSN 0021-9606. doi:10.1063/1.4907731. https://resolver.caltech.edu/CaltechAUTHORS:20150402-091624373

Berweger, Samuel and Weber, Joel C. and John, Jimmy et al. (2015) Microwave Near-Field Imaging of Two-Dimensional Semiconductors. Nano Letters, 15 (2). pp. 1122-1127. ISSN 1530-6984. doi:10.1021/nl504960u. https://resolver.caltech.edu/CaltechAUTHORS:20150324-085931498

Walczak, Karl and Chen, Yikai and Karp, Christoph et al. (2015) Modeling, Simulation, and Fabrication of a Fully Integrated, Acid-stable, Scalable Solar-Driven Water-Splitting System. ChemSusChem, 8 (3). pp. 544-551. ISSN 1864-5631. doi:10.1002/cssc.201402896. https://resolver.caltech.edu/CaltechAUTHORS:20150310-113150374

Jones, Ryan J. R. and Shinde, Aniketa and Guevarra, Dan et al. (2015) Parallel Electrochemical Treatment System and Application for Identifying Acid-Stable Oxygen Evolution Electrocatalysts. ACS Combinatorial Science, 17 (2). pp. 71-75. ISSN 2156-8952. doi:10.1021/co500148p. https://resolver.caltech.edu/CaltechAUTHORS:20150126-085330620

Pesenson, Misha Z. and Suram, Santosh K. and Gregoire, John M. (2015) Statistical Analysis and Interpolation of Compositional Data in Materials Science. ACS Combinatorial Science, 17 (2). pp. 130-136. ISSN 2156-8952. doi:10.1021/co5001458. https://resolver.caltech.edu/CaltechAUTHORS:20150120-090320534

Grzanna, J. and Lewerenz, H. J. (2015) Oscillations at the Si/electrolyte contact: Relation to Quantum Mechanics. Journal of Physics: Conference Series, 574 (1). Art. No. 012024. ISSN 1742-6596. doi:10.1088/1742-6596/574/1/012024. https://resolver.caltech.edu/CaltechAUTHORS:20150507-135543426

Shaner, Matthew R. and Hu, Shu and Sun, Ke et al. (2015) Stabilization of Si microwire arrays for solar-driven H₂O oxidation to O₂(g) in 1.0 M KOH(aq) using conformal coatings of amorphous TiO₂. Energy and Environmental Science, 8 (1). pp. 203-207. ISSN 1754-5692. doi:10.1039/c4ee03012e. https://resolver.caltech.edu/CaltechAUTHORS:20141117-083607403

Nielander, Adam C. and Shaner, Matthew R. and Papadantonakis, Kimberly M. et al. (2015) A taxonomy for solar fuels generators. Energy and Environmental Science, 8 (1). pp. 16-25. ISSN 1754-5692. doi:10.1039/c4ee02251c. https://resolver.caltech.edu/CaltechAUTHORS:20141008-080542214

Soriaga, Manuel P. and Baricuatro, Jack H. and Cummins, Kyle D. et al. (2015) Electrochemical surface science twenty years later: Expeditions into the electrocatalysis of reactions at the core of artificial photosynthesis. Surface Science, 631 . pp. 285-294. ISSN 0039-6028. doi:10.1016/j.susc.2014.06.028. https://resolver.caltech.edu/CaltechAUTHORS:20140917-091954518

Yang, Xiaogang and Liu, Rui and He, Yumin et al. (2015) Enabling practical electrocatalyst-assisted photoelectrochemical water splitting with earth abundant materials. Nano Research, 8 (1). pp. 56-81. ISSN 1998-0124. doi:10.1007/s12274-014-0645-2. https://resolver.caltech.edu/CaltechAUTHORS:20150220-072846889

Mitrovic, Slobodan and Cornell, Earl W. and Marcin, Martin R. et al. (2015) High-throughput on-the-fly scanning ultraviolet-visible dual-sphere spectrometer. Review of Scientific Instruments, 86 (1). Art. No. 013904. ISSN 0034-6748. doi:10.1063/1.4905365. https://resolver.caltech.edu/CaltechAUTHORS:20150120-081217429

Kim, Youn-Geun and Baricuatro, Jack Hess and Javier, Alnald et al. (2014) The Evolution of the Polycrystalline Copper Surface, First to Cu(111) and Then to Cu(100), at a Fixed CO_2RR Potential: A Study by Operando EC-STM. Langmuir, 30 (50). pp. 15053-15056. ISSN 0743-7463. doi:10.1021/la504445g. https://resolver.caltech.edu/CaltechAUTHORS:20141215-100027935

Saadi, Fadl H. and Carim, Azhar I. and Verlage, Erik et al. (2014) CoP as an Acid-Stable Active Electrocatalyst for the Hydrogen-Evolution Reaction: Electrochemical Synthesis, Interfacial Characterization and Performance Evaluation. Journal of Physical Chemistry C, 118 (50). pp. 29294-29300. ISSN 1932-7447. doi:10.1021/jp5054452. https://resolver.caltech.edu/CaltechAUTHORS:20141020-091512216

Sundararaman, Ravishankar and Narang, Prineha and Jermyn, Adam S. et al. (2014) Theoretical predictions for hot-carrier generation from surface plasmon decay. Nature Communications, 5 . Art. No. 5788. ISSN 2041-1723. PMCID PMC4284641. doi:10.1038/ncomms6788. https://resolver.caltech.edu/CaltechAUTHORS:20141219-150047470

Laga, Stephanie M. and Blakemore, James D. and Henling, Lawrence M. et al. (2014) Catalysis of Proton Reduction by a [BO_4]-Bridged Dicobalt Glyoxime. Inorganic Chemistry, 53 (24). pp. 12668-12670. ISSN 0020-1669. doi:10.1021/ic501804h. https://resolver.caltech.edu/CaltechAUTHORS:20141201-105741726

Shaffer, David W. and Johnson, Samantha I. and Rheingold, Arnold L. et al. (2014) Reactivity of a Series of Isostructural Cobalt Pincer Complexes with CO_2, CO, and H^+. Inorganic Chemistry, 53 (24). pp. 13031-13041. ISSN 0020-1669. doi:10.1021/ic5021725. https://resolver.caltech.edu/CaltechAUTHORS:20150122-111631531

Bruce, Jared P. and Asgari, Sommayeh and Ardo, Shane et al. (2014) Measurement of the Electrical Resistance of n-Type Si Microwire/p-Type Conducting Polymer Junctions for Use in Artificial Photosynthesis. Journal of Physical Chemistry C, 118 (48). pp. 27742-27748. ISSN 1932-7447. doi:10.1021/jp509211k. https://resolver.caltech.edu/CaltechAUTHORS:20150109-083207621

Lewerenz, Hans J. (2014) Semiconductor Surface Transformations for Photoelectrochemical Energy Conversion. Journal of the Electrochemical Society, 161 (13). H3117-H3129. ISSN 0013-4651. doi:10.1149/2.0211413jes. https://resolver.caltech.edu/CaltechAUTHORS:20150108-085815861

Kim, Youn-Geun and Soriaga, Manuel P. (2014) Cathodic regeneration of a clean and ordered Cu(100)-(1×1) surface from an air-oxidized and disordered electrode: An operando STM study. Journal of Electroanalytical Chemistry, 734 . pp. 7-9. ISSN 1572-6657. doi:10.1016/j.jelechem.2014.09.010. https://resolver.caltech.edu/CaltechAUTHORS:20141001-103653915

Gregoire, J. M. and Van Campen, D. G. and Miller, C. E. et al. (2014) High-throughput synchrotron X-ray diffraction for combinatorial phase mapping. Journal of Synchrotron Radiation, 21 (6). pp. 1262-1268. ISSN 0909-0495. doi:10.1107/S1600577514016488. https://resolver.caltech.edu/CaltechAUTHORS:20141205-093300451

McDonald, Michael B. and Ardo, Shane and Lewis, Nathan S. et al. (2014) Use of Bipolar Membranes for Maintaining Steady-State pH Gradients in Membrane-Supported, Solar-Driven Water Splitting. ChemSusChem, 7 (11). pp. 3021-3027. ISSN 1864-5631. doi:10.1002/cssc.201402288. https://resolver.caltech.edu/CaltechAUTHORS:20230330-372386000.2

Fountaine, Katherine T. and Lewerenz, Hans J. and Atwater, Harry A. (2014) Interplay of light transmission and catalytic exchange current in photoelectrochemical systems. Applied Physics Letters, 105 (17). Art. No. 173901. ISSN 0003-6951. doi:10.1063/1.4900612. https://resolver.caltech.edu/CaltechAUTHORS:20141103-094055916

Javier, Alnald and Li, Ding and Cruz, Juan et al. (2014) C–H activation and metalation at electrode surfaces: 2,3-dimethyl-1,4-dihydroxybenzene on Pd(pc) and Pd(111) studied by TLE, HREELS and DFT. Dalton Transactions, 43 (39). pp. 14798-14805. ISSN 1477-9226. doi:10.1039/c4dt02137a. https://resolver.caltech.edu/CaltechAUTHORS:20140829-081408528

Haber, Joel A. and Guevarra, Dan and Jung, Suho et al. (2014) Discovery of New Oxygen Evolution Reaction Electrocatalysts by Combinatorial Investigation of the Ni–La–Co–Ce Oxide Composition Space. ChemElectroChem, 1 (10). pp. 1613-1617. ISSN 2196-0216. doi:10.1002/celc.201402149. https://resolver.caltech.edu/CaltechAUTHORS:20141201-102711064

Han, Lihao and Abdi, Fatwa F. and van de Krol, Roel et al. (2014) Efficient Water-Splitting Device Based on a Bismuth Vanadate Photoanode and Thin-Film Silicon Solar Cells. ChemSusChem, 7 (10). pp. 2832-2838. ISSN 1864-5631. doi:10.1002/cssc.201402456. https://resolver.caltech.edu/CaltechAUTHORS:20140825-111015375

Pala, Ragip A. and Leenheer, Andrew J. and Lichterman, Michael et al. (2014) Measurement of minority-carrier diffusion lengths using wedge-shaped semiconductor photoelectrodes. Energy and Environmental Science, 7 (10). pp. 3424-3430. ISSN 1754-5692. doi:10.1039/C4EE01580K. https://resolver.caltech.edu/CaltechAUTHORS:20140825-152741705

Lichterman, Michael F. and Carim, Azhar I. and McDowell, Matthew T. et al. (2014) Stabilization of n-cadmium telluride photoanodes for water oxidation to O_2(g) in aqueous alkaline electrolytes using amorphous TiO_2 films formed by atomic-layer deposition. Energy and Environmental Science, 7 (10). pp. 3334-3337. ISSN 1754-5692. doi:10.1039/C4EE01914H. https://resolver.caltech.edu/CaltechAUTHORS:20140915-092918358

Jin, Jian and Walczak, Karl and Singh, Meenesh R. et al. (2014) An experimental and modeling/simulation-based evaluation of the efficiency and operational performance characteristics of an integrated, membrane-free, neutral pH solar-driven water-splitting system. Energy and Environmental Science, 7 (10). pp. 3371-3380. ISSN 1754-5692. doi:10.1039/c4ee01824a. https://resolver.caltech.edu/CaltechAUTHORS:20140820-110452543

Huang, Zhuangqun and McKone, James R. and Xiang, Chengxiang et al. (2014) Comparison between the measured and modeled hydrogen-evolution activity of Ni- or Pt-coated silicon photocathodes. International Journal of Hydrogen Energy, 39 (28). pp. 16220-16226. ISSN 0360-3199. doi:10.1016/j.ijhydene.2013.12.162. https://resolver.caltech.edu/CaltechAUTHORS:20140422-103752009

Carim, Azhar I. and Saadi, Fadl H. and Soriaga, Manuel P. et al. (2014) Electrocatalysis of the hydrogen-evolution reaction by electrodeposited amorphous cobalt selenide films. Journal of Materials Chemistry A, 2 (34). pp. 13835-13839. ISSN 2050-7488. doi:10.1039/C4TA02611J. https://resolver.caltech.edu/CaltechAUTHORS:20140804-095437360

Calvet, Wolfram and Lewerenz, Hans-Joachim and Pettenkofer, Christian (2014) Model experiments on growth modes and interface electronics of CuInS_2: Ultrathin epitaxial films on GaAs(100) substrates. Physica Status Solidi A, 211 (9). pp. 1981-1990. ISSN 1862-6300. doi:10.1002/pssa.201330429. https://resolver.caltech.edu/CaltechAUTHORS:20141017-073927206

Saadi, Fadl H. and Carim, Azhar I. and Velazquez, Jesus M. et al. (2014) Operando Synthesis of Macroporous Molybdenum Diselenide Films for Electrocatalysis of the Hydrogen-Evolution Reaction. ACS Catalysis, 4 (9). pp. 2866-2873. ISSN 2155-5435. https://resolver.caltech.edu/CaltechAUTHORS:20140804-090046189

McDowell, Matthew T. and Lichterman, Michael F. and Spurgeon, Joshua M. et al. (2014) Improved Stability of Polycrystalline Bismuth Vanadate Photoanodes by Use of Dual-Layer Thin TiO_2/Ni Coatings. Journal of Physical Chemistry C, 118 (34). pp. 19618-19624. ISSN 1932-7447. doi:10.1021/jp506133y. https://resolver.caltech.edu/CaltechAUTHORS:20140825-134317366

May, Matthias M. and Lewerenz, Hans-Joachim and Hannappel, Thomas (2014) Optical in Situ Study of InP(100) Surface Chemistry: Dissociative Adsorption of Water and Oxygen. Journal of Physical Chemistry C, 118 (33). pp. 19032-19041. ISSN 1932-7447. doi:10.1021/jp502955m. https://resolver.caltech.edu/CaltechAUTHORS:20140918-144401465

Chen, Yikai and Xiang, Chengxiang and Hu, Shu et al. (2014) Modeling the Performance of an Integrated Photoelectrolysis System with 10× Solar Concentrators. Journal of the Electrochemical Society, 161 (10). F1101-F1110. ISSN 0013-4651. doi:10.1149/2.0751410jes. https://resolver.caltech.edu/CaltechAUTHORS:20141001-112924015

Baricuatro, Jack H. and Kim, Youn-Geun and Saadi, Fadl H. et al. (2014) Heterogenization of a Water-Insoluble Molecular Complex for Catalysis of the Proton-Reduction Reaction in Highly Acidic Aqueous Solutions. Electrocatalysis, 5 (3). pp. 226-228. ISSN 1868-2529. doi:10.1007/s12678-014-0200-7. https://resolver.caltech.edu/CaltechAUTHORS:20140505-132735594

Hu, Shu and Shaner, Matthew R. and Beardslee, Joseph A. et al. (2014) Amorphous TiO_2 coatings stabilize Si, GaAs, and GaP photoanodes for efficient water oxidation. Science, 344 (6187). pp. 1005-1009. ISSN 0036-8075. doi:10.1126/science.1251428. https://resolver.caltech.edu/CaltechAUTHORS:20140515-133039268

Liu, Rui and Spurgeon, Joshua and Yang, Xiaogang (2014) Enhanced photoelectrochemical water-splitting performance of semiconductors by surface passivation layers. Energy and Environmental Science, 2014 (7). pp. 2504-2517. ISSN 1754-5692. doi:10.1039/C4EE00450G. https://resolver.caltech.edu/CaltechAUTHORS:20140804-092046492

Lacy, David C. and McCrory, Charles C. L. and Peters, Jonas C. (2014) Studies of Cobalt-Mediated Electrocatalytic CO_2 Reduction Using a Redox-Active Ligand. Inorganic Chemistry, 53 (10). pp. 4980-4988. ISSN 0020-1669. PMCID PMC4033636. doi:10.1021/ic403122j. https://resolver.caltech.edu/CaltechAUTHORS:20140505-142420147

Hsieh, Chung-Hung and Ding, Shengda and Erdem, Özlen F. et al. (2014) Redox active iron nitrosyl units in proton reduction electrocatalysis. Nature Communications, 5 . Art. No. 3684. ISSN 2041-1723. doi:10.1038/ncomms4684. https://resolver.caltech.edu/CaltechAUTHORS:20140314-123801645

Leenheer, Andrew J. and Narang, Prineha and Lewis, Nathan S. et al. (2014) Solar energy conversion via hot electron internal photoemission in metallic nanostructure: Efficiency estimates. Journal of Applied Physics, 115 (13). Art. No. 134301. ISSN 0021-8979. doi:10.1063/1.4870040. https://resolver.caltech.edu/CaltechAUTHORS:20140408-084811849

Huang, Zhuangqun and Xiang, Chengxiang and Lewerenz, Hans-Joachim et al. (2014) Two stories from the ISACS 12 conference: solar-fuel devices and catalyst identification. Energy and Environmental Science, 7 (4). pp. 1207-1211. ISSN 1754-5692. doi:10.1039/c3ee90043f. https://resolver.caltech.edu/CaltechAUTHORS:20140425-070837177

Supplie, Oliver and May, Matthias M. and Stange, Helena et al. (2014) Materials for light-induced water splitting: In situ controlled surface preparation of GaPN epilayers grown lattice-matched on Si(100). Journal of Applied Physics, 116 (11). Art. No. 113509. ISSN 0021-8979. doi:10.1063/1.4869121. https://resolver.caltech.edu/CaltechAUTHORS:20140508-113013593

Haber, Joel A. and Xiang, Chengxiang and Guevarra, Dan et al. (2014) High-Throughput Mapping of the Electrochemical Properties of (Ni-Fe-Co-Ce)O_x Oxygen-Evolution Catalysts. ChemElectroChem, 1 (3). pp. 524-528. ISSN 2196-0216. doi:10.1002/celc.201300229. https://resolver.caltech.edu/CaltechAUTHORS:20140731-100438286

Xiang, Chengxiang and Haber, Joel and Marcin, Martin et al. (2014) Mapping Quantum Yield for (Fe−Zn−Sn−Ti)O_x Photoabsorbers Using a High Throughput Photoelectrochemical Screening System. ACS Combinatorial Science, 16 (3). pp. 120-127. ISSN 2156-8952. doi:10.1021/co400081w. https://resolver.caltech.edu/CaltechAUTHORS:20140218-144233923

Chmielowiec, Brian and Saadi, Fadl H. and Baricuatro, Jack H. et al. (2014) Molecular catalysis that transpires only when the complex is heterogenized: Studies of a hydrogenase complex surface-tethered on polycrystalline and (1 1 1)-faceted gold by EC, PM-FT-IRRAS, HREELS, XPS and STM. Journal of Electroanalytical Chemistry, 716 . pp. 63-70. ISSN 1572-6657. doi:10.1016/j.jelechem.2013.12.025. https://resolver.caltech.edu/CaltechAUTHORS:20140204-101048359

Baricuatro, Jack H. and Ehlers, Charles B. and Cummins, Kyle D. et al. (2014) Structure and composition of Cu(hkl) surfaces exposed to O_2 and emersed from alkaline solutions: Prelude to UHV-EC studies of CO_2 reduction at well-defined copper catalysts. Journal of Electroanalytical Chemistry, 716 . pp. 101-105. ISSN 1572-6657. doi:10.1016/j.jelechem.2013.10.001. https://resolver.caltech.edu/CaltechAUTHORS:20140312-092635775

Velazquez, Jesus M. and Saadi, Fadl H. and Pieterick, Adam P. et al. (2014) Synthesis and hydrogen-evolution activity of tungsten selenide thin films deposited on tungsten foils. Journal of Electroanalytical Chemistry, 716 . pp. 45-48. ISSN 0022-0728. doi:10.1016/j.jelechem.2013.11.030. https://resolver.caltech.edu/CaltechAUTHORS:20140121-113850320

Narang, Prineha and Chen, Shiyou and Coronel, Naomi C. et al. (2014) Bandgap Tunability in Zn(Sn,Ge)N_2 Semiconductor Alloys. Advanced Materials, 26 (8). pp. 1235-1241. ISSN 0935-9648. doi:10.1002/adma.201304473. https://resolver.caltech.edu/CaltechAUTHORS:20131209-100236108

Haber, Joel A. and Cai, Yun and Jung, Suho et al. (2014) Discovering Ce-rich oxygen evolution catalysts, from high throughput screening to water electrolysis. Energy and Environmental Science, 7 (2). pp. 682-688. ISSN 1754-5692. doi:10.1039/C3EE43683G. https://resolver.caltech.edu/CaltechAUTHORS:20140325-130923791

Xiang, Chengxiang and Suram, Santosh K. and Haber, Joel A. et al. (2014) High-Throughput Bubble Screening Method for Combinatorial Discovery of Electrocatalysts for Water Splitting. ACS Combinatorial Science, 16 (2). pp. 47-52. ISSN 2156-8952. doi:10.1021/co400151h. https://resolver.caltech.edu/CaltechAUTHORS:20140127-093320786

Shaner, Matthew R. and Fountaine, Katherine T. and Ardo, Shane et al. (2014) Photoelectrochemistry of core–shell tandem junction n–p^+-Si/n-WO_3 microwire array photoelectrodes. Energy and Environmental Science, 7 (2). pp. 779-790. ISSN 1754-5692. doi:10.1039/C3EE43048K. https://resolver.caltech.edu/CaltechAUTHORS:20140110-150648310

Warren, Emily L. and Atwater, Harry A. and Lewis, Nathan S. (2014) Silicon Microwire Arrays for Solar Energy-Conversion Applications. Journal of Physical Chemistry C, 118 (2). pp. 747-759. ISSN 1932-7447. doi:10.1021/jp406280x. https://resolver.caltech.edu/CaltechAUTHORS:20140227-090625946

Chen, Shiyou and Narang, Prineha and Atwater, Harry A. et al. (2014) Phase Stability and Defect Physics of a Ternary ZnSnN_2 Semiconductor: First Principles Insights. Advanced Materials, 26 (2). pp. 311-315. ISSN 0935-9648. doi:10.1002/adma.201302727. https://resolver.caltech.edu/CaltechAUTHORS:20131009-164328252

McKone, James R. and Lewis, Nathan S. and Gray, Harry B. (2014) Will Solar-Driven Water-Splitting Devices See the Light of Day? Chemistry of Materials, 26 (1). pp. 407-414. ISSN 0897-4756. doi:10.1021/cm4021518. https://resolver.caltech.edu/CaltechAUTHORS:20140228-085825144

Gregoire, J. M. and Haber, J. A. and Mitrovic, S. et al. (2014) Enabling Solar Fuels Technology With High Throughput Experimentation. MRS Proceedings, 1654 . Art. No. opl.2014.29. ISSN 1946-4274. doi:10.1557/opl.2014.29. https://resolver.caltech.edu/CaltechAUTHORS:20140617-094404706

Sanabria-Chinchilla, Jean and Javier, Alnald and Crouthers, Danielle et al. (2014) Immobilization-Enabled Proton Reduction Catalysis by a Di-iron Hydrogenase Mimic. Electrocatalysis, 5 (1). pp. 5-7. ISSN 1868-2529. https://resolver.caltech.edu/CaltechAUTHORS:20140211-073815565

Lichterman, Michael F. and Shaner, Matthew R. and Handler, Sheila G. et al. (2013) Enhanced Stability and Activity for Water Oxidation in Alkaline Media with Bismuth Vanadate Photoelectrodes Modified with a Cobalt Oxide Catalytic Layer Produced by Atomic Layer Deposition. Journal of Physical Chemistry Letters, 4 (23). pp. 4188-4191. ISSN 1948-7185. doi:10.1021/jz4022415. https://resolver.caltech.edu/CaltechAUTHORS:20140110-084420760

Haussener, Sophia and Hu, Shu and Xiang, Chengxiang et al. (2013) Simulations of the irradiation and temperature dependence of the efficiency of tandem photoelectrochemical water-splitting systems. Energy and Environmental Science, 6 (12). pp. 3605-3618. ISSN 1754-5692. doi:10.1039/c3ee41302k. https://resolver.caltech.edu/CaltechAUTHORS:20131224-102701042

McCrory, Charles C. L. and Jung, Suho and Peters, Jonas C. et al. (2013) Benchmarking Heterogeneous Electrocatalysts for the Oxygen Evolution Reaction. Journal of the American Chemical Society, 135 (45). pp. 16977-16987. ISSN 0002-7863. doi:10.1021/ja407115p. https://resolver.caltech.edu/CaltechAUTHORS:20131213-151603830

Lin, Tzu-Pin and Peters, Jonas C. (2013) Boryl-Mediated Reversible H_2 Activation at Cobalt: Catalytic Hydrogenation, Dehydrogenation, and Transfer Hydrogenation. Journal of the American Chemical Society, 135 (41). pp. 15310-15313. ISSN 0002-7863. doi:10.1021/ja408397v. https://resolver.caltech.edu/CaltechAUTHORS:20131105-144406165

May, Matthias M. and Supplie, Oliver and Höhn, Christian et al. (2013) The interface of GaP(100) and H_2O studied by photoemission and reflection anisotropy spectroscopy. New Journal of Physics, 15 (10). Art. No. 103003. ISSN 1367-2630. doi:10.1088/1367-2630/15/10/103003. https://resolver.caltech.edu/CaltechAUTHORS:20131104-105944560

Hu, Shu and Xiang, Chengxiang and Haussener, Sophia et al. (2013) An analysis of the optimal band gaps of light absorbers in integrated tandem photoelectrochemical water-splitting systems. Energy and Environmental Science, 6 (10). pp. 2984-2993. ISSN 1754-5692. doi:10.1039/c3ee40453f. https://resolver.caltech.edu/CaltechAUTHORS:20131118-152050309

Shaner, Matthew R. and Fountaine, Katherine T. and Lewerenz, Hans-Joachim (2013) Current-voltage characteristics of coupled photodiode-electrocatalyst devices. Applied Physics Letters, 103 (14). Art. No. 143905. ISSN 0003-6951. doi:10.1063/1.4822179. https://resolver.caltech.edu/CaltechAUTHORS:20131107-150452899

Haussener, Sophia and Hu, Shu and Xiang, Chengxiang et al. (2013) Simulations of the Irradiation and Temperature Dependence of the Efficiency of Tandem Photoelectrochemical Water-splitting Systems. ECS Transactions, 58 (2). pp. 293-303. ISSN 1938-5862. doi:10.1149/05802.0293ecst. https://resolver.caltech.edu/CaltechAUTHORS:20230329-637828000.2

Letilly, Marika and Skorupska, Katarzyna and Lewerenz, Hans-Joachim (2013) Initial Phase of Photoelectrochemical Conditioning of Silicon in Alkaline Media: Surface Chemistry and Topography. Journal of Physical Chemistry C, 117 (32). pp. 16381-16391. ISSN 1932-7447. doi:10.1021/jp401853p. https://resolver.caltech.edu/CaltechAUTHORS:20130906-091022940

Xiao, Kechao and Gregoire, John M. and McCluskey, Patrick J. et al. (2013) Scanning AC nanocalorimetry combined with in-situ x-ray diffraction. Journal of Applied Physics, 113 (24). Art. No. 243501. ISSN 0021-8979. PMCID PMC3676369. doi:10.1063/1.4811686. https://resolver.caltech.edu/CaltechAUTHORS:20130830-140035652

Gregoire, J. M. and Xiang, C. and Mitrovic, S. et al. (2013) Combined Catalysis and Optical Screening for High Throughput Discovery of Solar Fuels Catalysts. ECS Transactions, 50 (49). pp. 9-20. ISSN 1938-5862. doi:10.1149/05049.0009ecst. https://resolver.caltech.edu/CaltechAUTHORS:20140609-083826658

Sanabria-Chinchilla, Jean and Chen, Xiaole and Li, Ding et al. (2013) Chemisorption-Isotherm Measurements at Electrode Surfaces by Quantitative High-Resolution Electron Energy Loss Spectroscopy. Electrocatalysis, 4 (2). pp. 101-103. ISSN 1868-2529. doi:10.1007/s12678-013-0125-6. https://resolver.caltech.edu/CaltechAUTHORS:20130606-094123039

Hu, Shu and Chi, Chun-Yung and Fountaine, Katherine T. et al. (2013) Optical, electrical, and solar energy-conversion properties of gallium arsenide nanowire-array photoanodes. Energy and Environmental Science, 6 (6). pp. 1879-1890. ISSN 1754-5692. doi:10.1039/c3ee40243f. https://resolver.caltech.edu/CaltechAUTHORS:20130717-111233079

Chi, Chun-Yung and Chang, Chia-Chi and Hu, Shu et al. (2013) Twin-Free GaAs Nanosheets by Selective Area Growth: Implications for Defect-Free Nanostructures. Nano Letters, 13 (6). pp. 2506-2515. ISSN 1530-6984. doi:10.1021/nl400561j. https://resolver.caltech.edu/CaltechAUTHORS:20130819-091048166

Gregoire, John M. and Xiao, Kechao and McCluskey, Patrick J. et al. (2013) In-situ X-ray diffraction combined with scanning AC nanocalorimetry applied to a Fe_(0.84)Ni_(0.16) thin-film sample. Applied Physics Letters, 102 (20). Art. No. 201902. ISSN 0003-6951. PMCID PMC3676369. doi:10.1063/1.4806972. https://resolver.caltech.edu/CaltechAUTHORS:20130813-135504917

Coridan, Robert H. and Shaner, Matthew and Wiggenhorn, Craig et al. (2013) Electrical and Photoelectrochemical Properties of WO_3/Si Tandem Photoelectrodes. Journal of Physical Chemistry C, 117 (14). pp. 6949-6957. ISSN 1932-7447. doi:10.1021/jp311947x. https://resolver.caltech.edu/CaltechAUTHORS:20130516-133146126

Muñoz, A. G. and Heine, C. and Lublow, M. et al. (2013) Photoelectrochemical Conditioning of MOVPE p-InP Films for Light-Induced Hydrogen Evolution: Chemical, Electronic and Optical Properties. ECS Journal of Solid State Science and Technology, 2 (4). Q51-Q58. ISSN 2162-8769. doi:10.1149/2.016304jss. https://resolver.caltech.edu/CaltechAUTHORS:20130709-110434578

Baricuatro, Jack H. and Soto, José C. and Cummins, Kyle D. et al. (2013) High-resolution electron energy loss spectroscopy of anions chemisorbed on electrode surfaces: The effect of counter cations. Electrochemistry Communications, 27 . pp. 176-179. ISSN 1388-2481. doi:10.1016/j.elecom.2012.11.005. https://resolver.caltech.edu/CaltechAUTHORS:20130412-084406072

Gregoire, John M. and Xiang, Chengxiang and Liu, Xiaonao et al. (2013) Scanning droplet cell for high throughput electrochemical and photoelectrochemical measurements. Review of Scientific Instruments, 84 (2). Art. No. 024102. ISSN 0034-6748. doi:10.1063/1.4790419. https://resolver.caltech.edu/CaltechAUTHORS:20130509-154116203

Gregoire, J. M. and Xiang, C. and Mitrovic, S. et al. (2013) Combined Catalysis and Optical Screening for High Throughput Discovery of Solar Fuels Catalysts. Journal of the Electrochemical Society, 160 (4). F337-F342. ISSN 0013-4651. doi:10.1149/2.035304jes. https://resolver.caltech.edu/CaltechAUTHORS:20130523-112147351

McKone, James R. and Peiterick, Adam P. and Gray, Harry B. et al. (2013) Hydrogen Evolution from Pt/Ru-Coated p-Type WSe_2 Photocathodes. Journal of the American Chemical Society, 135 (1). pp. 223-231. ISSN 0002-7863. doi:10.1021/ja308581g. https://resolver.caltech.edu/CaltechAUTHORS:20130205-103231488

Lewerenz, H. J. (2013) On the Structure of the Helmholtz Layer and its Implications on Electrode Kinetics. ECS Transactions, 50 (52). pp. 3-20. ISSN 1938-5862. doi:10.1149/05052.0003ecst. https://resolver.caltech.edu/CaltechAUTHORS:20140312-093801401

Haussener, Sophia and Xiang, Chengxiang and Spurgeon, Joshua M. et al. (2012) Modeling, simulation, and design criteria for photoelectrochemical water-splitting systems. Energy and Environmental Science, 5 (12). pp. 9922-9935. ISSN 1754-5692. doi:10.1039/c2ee23187e. https://resolver.caltech.edu/CaltechAUTHORS:20130107-104614254

Xiang, Chengxiang and Meng, Andrew C. and Lewis, Nathan S. (2012) Evaluation and optimization of mass transport of redox species in silicon microwire-array photoelectrodes. Proceedings of the National Academy of Sciences of the United States of America, 109 (39). pp. 15622-15627. ISSN 0027-8424. PMCID PMC3465373. doi:10.1073/pnas.1118338109. https://resolver.caltech.edu/CaltechAUTHORS:20121101-150325621

Jeon, Seokmin and Kim, Hyungjun and Goddard, William A., III et al. (2012) DFT Study of Water Adsorption and Decomposition on a Ga-Rich GaP(001)(2×4) Surface. Journal of Physical Chemistry C, 116 (33). pp. 17604-17612. ISSN 1932-7447. doi:10.1021/jp3041555. https://resolver.caltech.edu/CaltechAUTHORS:20130118-105914846

Manthiram, Karthish and Alivisatos, A. Paul (2012) Tunable Localized Surface Plasmon Resonances in Tungsten Oxide Nanocrystals. Journal of the American Chemical Society, 134 (9). pp. 3995-3998. ISSN 0002-7863. doi:10.1021/ja211363w. https://resolver.caltech.edu/CaltechAUTHORS:20220505-565529000

Yu, Weilai and Young, James L. and Deutsch, Todd G. et al. (2021) Understanding the Stability of Etched or Platinized p-GaInP Photocathodes for Solar-Driven H₂ Evolution. ACS Applied Materials & Interfaces, 13 (48). pp. 57350-57361. ISSN 1944-8244. doi:10.1021/acsami.1c18243. https://resolver.caltech.edu/CaltechAUTHORS:20201129-123456789

Book Section

Li, Xueqian and Liu, Jie and Everitt, Henry O. (2021) Untangling Thermal and Nonthermal Effects in Plasmonic Photocatalysis. In: Plasmonic Catalysis: From Fundamentals to Applications. Wiley , Weinheim, pp. 191-230. ISBN 9783527347506. https://resolver.caltech.edu/CaltechAUTHORS:20210622-165124100

Bai, Junwen and Ament, Sebastian and Perez, Guillaume et al. (2018) An Efficient Relaxed Projection Method for Constrained Non-negative Matrix Factorization with Application to the Phase-Mapping Problem in Materials Science. In: Integration of Constraint Programming, Artificial Intelligence, and Operations Research. Lecture Notes in Computer Science. No.10848. Springer , Cham, Switzerland, pp. 52-62. ISBN 978-3-319-93030-5. https://resolver.caltech.edu/CaltechAUTHORS:20180607-155251991

Lewerenz, Hans-Joachim and Sharp, Ian D. (2018) Concepts of Photoelectrochemical Energy Conversion and Fuel Generation. In: Integrated Solar Fuel Generators. Energy and Environment Series. No.22. Royal Society of Chemistry , Cambridge, pp. 3-42. ISBN 978-1-78262-555-1. https://resolver.caltech.edu/CaltechAUTHORS:20180910-105905620

McCrory, Charles C. L. and Jung, Suho and Kallick, Jeremy (2018) Evaluating Electrocatalysts for Solar Water-splitting Reactions. In: Integrated Solar Fuel Generators. Energy and Environment Series. No.22. Royal Society of Chemistry , Cambridge, pp. 154-181. ISBN 978-1-78262-555-1. https://resolver.caltech.edu/CaltechAUTHORS:20180910-110355357

Gregoire, John M. and Boyd, David A. and Guevarra, Dan et al. (2018) High Throughput Experimentation for the Discovery of Water Splitting Materials. In: Integrated Solar Fuel Generators. Energy and Environment Series. No.22. Royal Society of Chemistry , Cambridge, pp. 307-340. ISBN 978-1-78262-555-1. https://resolver.caltech.edu/CaltechAUTHORS:20180910-110703060

Xiang, Chengxiang and Walczak, Karl and Haber, Joel et al. (2018) Prototyping Development of Integrated Solar-driven Water-splitting Cells. In: Integrated Solar Fuel Generators. Energy and Environment Series. No.22. Royal Society of Chemistry , Cambridge, pp. 389-453. ISBN 978-1-78262-555-1. https://resolver.caltech.edu/CaltechAUTHORS:20180910-111352528

Sokhoyan, Ruzan and Kafaie Shirmanesh, Ghazaleh and Lu, Yu-Jung et al. (2017) Tunable optical response and purcell enhancement of gated plasmonic structures. In: 2017 International Conference on Optical MEMS and Nanophotonics. IEEE , Piscataway, NJ, pp. 1-2. ISBN 978-1-5386-0735-0. https://resolver.caltech.edu/CaltechAUTHORS:20171006-133218360

Kelzenberg, Michael D. and Espinet-González, Pilar and Vaidya, Nina et al. (2017) Design and Prototyping Efforts for the Space Solar Power Initiative. In: 2017 IEEE 44th Photovoltaic Specialist Conference (PVSC). IEEE , Piscataway, NJ, pp. 558-561. ISBN 978-1-5090-5605-7. https://resolver.caltech.edu/CaltechAUTHORS:20181108-154443049

Omelchenko, Stefan T. and Tolstova, Yulia and Atwater, Harry A. et al. (2017) Excitonic effects in photovoltaic materials with large exciton binding energies. In: 2017 IEEE 44th Photovoltaic Specialist Conference (PVSC). IEEE , Piscataway, NJ, pp. 1-4. ISBN 978-1-5090-5605-7. https://resolver.caltech.edu/CaltechAUTHORS:20180601-090256322

Espinet-González, Pilar and Vinogradova, Tatiana and Kelzenberg, Michael D. et al. (2017) Impact of Space Radiation Environment on Concentrator Photovoltaic Systems. In: 2017 IEEE 44th Photovoltaic Specialist Conference (PVSC). IEEE , Piscataway, NJ, pp. 512-516. ISBN 978-1-5090-5605-7. https://resolver.caltech.edu/CaltechAUTHORS:20181109-074226646

Vaidya, Nina and Kelzenberg, Michael D. and Espinet-González, Pilar et al. (2017) Lightweight Carbon Fiber Mirrors for Solar Concentrator Applications. In: 2017 IEEE 44th Photovoltaic Specialist Conference (PVSC). IEEE , Piscataway, NJ, pp. 572-577. ISBN 978-1-5090-5605-7. https://resolver.caltech.edu/CaltechAUTHORS:20181109-075349019

Bai, Junwen and Bjorck, Johan and Xue, Yexiang et al. (2017) Relaxation Methods for Constrained Matrix Factorization Problems: Solving the Phase Mapping Problem in Materials Discovery. In: Integration of AI and OR Techniques in Constraint Programming. Lecture Notes in Computer Science . No.10335. Springer , Cham, Switzerland, pp. 104-112. ISBN 978-3-319-59775-1. https://resolver.caltech.edu/CaltechAUTHORS:20170711-130810289

Lewis, Nathan S. (2016) Progress Towards a Synergistically Integrated, Scalable Solar Fuels Generator. In: Nanotechnology: Delivering on the Promise. ACS Symposium Series. Vol.2. No.1224. American Chemical Society , Washington, DC, pp. 3-22. ISBN 9780841231467. https://resolver.caltech.edu/CaltechAUTHORS:20161026-151926632

Saive, Rebecca and Bukowsky, Colton R. and Yalamanchili, Sisir et al. (2016) Effectively transparent contacts (ETCs) for solar cells. In: 2016 IEEE 43rd Photovoltaic Specialists Conference (PVSC). IEEE , Piscataway, NJ, pp. 3612-3615. ISBN 9781509027248. https://resolver.caltech.edu/CaltechAUTHORS:20190308-082250884

Omelchenko, Stefan T. and Tolstova, Yulia and Atwater, Harry A. et al. (2016) Excitonic effects in photovoltaic materials with large exciton binding energies. In: IEEE 43rd Photovoltaic Specialists Conference. IEEE , Piscataway, NJ, pp. 3616-3619. ISBN 978-1-5090-2724-8. https://resolver.caltech.edu/CaltechAUTHORS:20161128-152532394

Suram, Santosh K. and Pesenson, Meyer Z. and Gregoire, John M. (2015) High Throughput Combinatorial Experimentation + Informatics = Combinatorial Science. In: Information Science for Materials Discovery and Design. Springer Series in Materials Science. No.225. Springer , Cham, Switzerland, pp. 271-300. ISBN 978-3-319-23870-8. https://resolver.caltech.edu/CaltechAUTHORS:20170718-103549107

Tolstova, Yulia and Wilson, Samantha S. and Omelchenko, Stefan T. et al. (2015) Molecular Beam Epitaxy of Cu_2O Heterostructures for Photovoltaics. In: IEEE 42nd Photovoltaic Specialist Conference (PVSC). IEEE , Piscataway, NJ, pp. 1-4. https://resolver.caltech.edu/CaltechAUTHORS:20151223-114554576

Omelchenko, Stefan T. and Tolstova, Yulia and Wilson, Samantha S. et al. (2015) Single crystal Cu_2O photovoltaics by the floating zone method. In: IEEE 42nd Photovoltaic Specialist Conference (PVSC). IEEE , Piscataway, NJ, pp. 1-4. https://resolver.caltech.edu/CaltechAUTHORS:20151224-073038812

Lloyd, John V. and Kosten, Emily D. and Warmann, Emily C. et al. (2014) Ray trace optimization of a light trapping filtered concentrator for spectrum splitting photovoltaics. In: IEEE 40th Photovoltaic Specialist Conference (PVSC). IEEE , Piscataway, NJ, pp. 2249-2252. ISBN 978-1-4799-4398-2. https://resolver.caltech.edu/CaltechAUTHORS:20170123-171959817

May, Matthias M. and Supplie, Oliver and Höhn, Christian et al. (2013) Water-induced modifications of GaP(100) and InP(100) surfaces studied by photoelectron spectroscopy and reflection anisotropy spectroscopy. In: Solar Hydrogen and Nanotechnology VIII. Proceedings of SPIE. No.8822. Society of Photo-Optical Instrumentation Engineers (SPIE) , Bellingham, WA, Art. No. 88220M. ISBN 9780819496720. https://resolver.caltech.edu/CaltechAUTHORS:20190917-140930361

Lewerenz, Hans-Joachim and Peter, Laurence (2013) New Perspectives and a Review of Progress. In: Photoelectrochemical Water Splitting: Materials, Processes and Architectures. RSC Energy and Environment Series. No.9. Royal Society of Chemistry , Cambridge, pp. 419-449. ISBN 978-1-84973-647-3. https://resolver.caltech.edu/CaltechAUTHORS:20140728-130422252

McKone, James and Lewis, Nathan (2013) Structured Materials for Photoelectrochemical Water Splitting. In: Photoelectrochemical Water Splitting: Materials, Processes and Architectures. RSC Energy and Environment Series. No.9. Royal Society of Chemistry , Cambridge, pp. 52-82. ISBN 978-1-84973-647-3. https://resolver.caltech.edu/CaltechAUTHORS:20140728-125520169

Report or Paper

Statt, Michael J. and Rohr, Brian A. and Guevarra, Dan et al. (2023) The Materials Experiment Knowledge Graph. . doi:10.26434/chemrxiv-2023-md55t. (Unpublished) https://resolver.caltech.edu/CaltechAUTHORS:20230524-373605000.1

Statt, Michael J. and Rohr, Brian A. and Brown, Kris et al. (2021) ESAMP: Event-Sourced Architecture for Materials Provenance Management and Application to Accelerated Materials Discovery. . doi:10.26434/chemrxiv.14583258.v1. (Unpublished) https://resolver.caltech.edu/CaltechAUTHORS:20210629-214641737

Jiang, Hongyan and Tao, Xuecheng and Kammler, Marvin et al. (2020) Nuclear Quantum Effects in Scattering of H and D from Graphene. . (Unpublished) https://resolver.caltech.edu/CaltechAUTHORS:20210929-230209364

Zhou, Jin-Jian and Bernardi, Marco (2019) Unveiling the Origin of Charge Transport in SrTiO_3 Beyond the Quasiparticle Regime. . (Unpublished) https://resolver.caltech.edu/CaltechAUTHORS:20190513-123336733

Manby, Frederick R. and Miller, Thomas F., III and Bygrave, Peter J. et al. (2019) entos: A Quantum Molecular Simulation Package. . doi:10.26434/chemrxiv.7762646.v2. (Unpublished) https://resolver.caltech.edu/CaltechAUTHORS:20200110-151818156

Zhou, Jin-Jian and Hellman, Olle and Bernardi, Marco (2018) Temperature Dependent Electron-Phonon Scattering and Electron Mobility in SrTiO_3 Perovskite from First Principles. . (Unpublished) https://resolver.caltech.edu/CaltechAUTHORS:20180703-140325969

Tagliabue, Giulia and Jermyn, Adam S. and Sundararaman, Ravishankar et al. (2017) Hot Carrier Dynamics in Photoexcited Gold Nanostructures: Role of Interband Excitations and Evidence for Ballistic Transport. . (Submitted) https://resolver.caltech.edu/CaltechAUTHORS:20171023-104952776

Conference or Workshop Item

Haber, Joel and Stein, Helge S. and Guevarra, Dan et al. (2019) Functional mapping reveals mechanistic clusters for OER catalysis across (Cu-Mn-Ta-Co-Sn-Fe)Ox composition and pH space. In: 258th ACS National Meeting & Exposition, 25-29 August 2019, San Diego, CA. https://resolver.caltech.edu/CaltechAUTHORS:20190812-111645069

Labinger, Jay Alan (2019) History (and pre-history) of the discovery and chemistry of the noble gases. In: 258th ACS National Meeting & Exposition, 25-29 August 2019, San Diego, CA. https://resolver.caltech.edu/CaltechAUTHORS:20190812-112253672

Newhouse, Paul and Guevarra, Dan and Umehara, Mitsu et al. (2019) Multi-modal optimization of bismuth vanadate photoanodes via combinatorial alloying and hydrogen processing. In: 258th ACS National Meeting & Exposition, 25-29 August 2019, San Diego, CA. https://resolver.caltech.edu/CaltechAUTHORS:20190812-125247272

Gregoire, John (2018) Accelerated experimental materials discovery through integration with theory and artificial intelligence. In: 255th American Chemical Society National Meeting & Exposition, March 18-22, 2018, New Orleans, LA. https://resolver.caltech.edu/CaltechAUTHORS:20180412-075704210

Haber, Joel and Guevarra, Dan and Shinde, Aniketa et al. (2018) Development of solar fuels photoanodes through combinatorial integration of multifunctional Fe-Ce oxide coatings on BiVO4 as a function of coating composition, loading, and electrolyte. In: 255th American Chemical Society National Meeting & Exposition, March 18-22, 2018, New Orleans, LA. https://resolver.caltech.edu/CaltechAUTHORS:20180412-155950683

Haber, Joel and Guevarra, Dan and Jones, R. J. R. et al. (2018) High throughput, multi-pH evaluation of earth-abundant pseudo-quaternary metal oxide catalysts for the oxygen evolution reaction. In: 255th American Chemical Society National Meeting & Exposition, March 18-22, 2018, New Orleans, LA. https://resolver.caltech.edu/CaltechAUTHORS:20180412-160639482

Lewis, Nathan S. (2018) Sunlight-driven hydrogen formation by membrane-supported photoelectrochemical water splitting. In: 255th American Chemical Society National Meeting & Exposition, March 18-22, 2018, New Orleans, LA. https://resolver.caltech.edu/CaltechAUTHORS:20180413-153323263

Liu, Guiji and Eichhorn, Johanna and Haber, Joel et al. (2017) Optical, morphological, and electrochemical multimodal characterization for integrated BiVO4 photoanodes. In: 254th American Chemical Society National Meeting & Exposition, 20-24 August 2017, Washington, DC. https://resolver.caltech.edu/CaltechAUTHORS:20180502-083014371

Haber, Joel and Guevarra, Dan and Shinde, Aniketa et al. (2017) Development of solar fuels photoanodes through combinatorial integration of Ni- La-Co-Ce oxide and Ni-Fe-Co-Ce oxide catalysts on BiVO₄. In: 253rd American Chemical Society National Meeting & Exposition, 2-6 April 2017, San Francisco, CA. https://resolver.caltech.edu/CaltechAUTHORS:20170505-132757377

Gregoire, John (2017) High throughput discovery of solar fuels photoanodes. In: 253rd American Chemical Society National Meeting & Exposition, April 2-6, 2017, San Francisco, CA. https://resolver.caltech.edu/CaltechAUTHORS:20170509-103759935

Newhouse, Paul and Boyd, David and Shinde, Aniketa et al. (2017) Solar fuels photoanodes prepared by inkjet printing of copper vanadates. In: 253rd American Chemical Society National Meeting & Exposition, April 2-6, 2017, San Francisco, CA. https://resolver.caltech.edu/CaltechAUTHORS:20170508-105609944

Haber, Joel and Guevarra, Dan and Shinde, Aniketa et al. (2016) Development of solar fuels photoanodes through combinatorial integration of Ni-La-Co-Ce oxide and Ni-Fe-Co-Ce oxide catalysts on BiVO₄. In: 20th Annual Green Chemistry & Engineering Conference, 14-16 June 2016, Portland, OR. https://resolver.caltech.edu/CaltechAUTHORS:20160622-150845222

Goddard, William and Cheng, Tao and Xiao, Hai (2016) Detailed reaction mechanisms for oxygen-reduction and CO_2-reduction reactions at electrode surfaces. In: 251st American Chemical Society National Meeting & Exposition, March 13-17, 2016, San Diego, CA. https://resolver.caltech.edu/CaltechAUTHORS:20160331-093542250

Haber, Joel A. and Jung, Suho and Guevarra, Dan et al. (2014) Discovering Ce-rich oxygen evolution catalysts, from high throughput screening to water electrolysis. In: 247th ACS National Meeting & Exposition, March 16-20, 2014, Dallas, TX. https://resolver.caltech.edu/CaltechAUTHORS:20140425-081906501