+ 2021
Abdelsamie, M., Li, T., Babbe, F., Xu, J., Han, Q., Blum, V., Sutter-Fella, C. M., Mitzi, D., Toney, M. Mechanism of Additive-Assisted Room-Temperature Processing of Metal Halide Perovskite Thin Films., ACS Appl. Mater. Interfaces, https://doi.org/10.1021/acsami.0c22630 (2021).
Andriuc, O., Siron, M., Monatoya, J., Horton, M., Persson, K., Automated Adsorption Workflow for Semiconductor Surfaces and the Application to Zinc Telluride., J. Chem. Inf. Model, 61 (8), 3908-3916, DOI: https://doi.org/10.1021/acs.jcim.1c00340 (2021).
Baricuatro, J. H., Kwon, S., Kim, Y.-G., Cummins, K. D., Naserifar, S., Goddard, W. A. Operando Electrochemical Spectroscopy for CO on Cu(100) at pH 1 to 13: Validation of Grand Canonical Potential Predictions. ACS Catal., 11(5), 3173-3181, https://doi.org/10.1021/acscatal.0c05564 (2021).
Berger, E., Jamnuch, S., Uzundal, C., Woodhal, C., et al. Extreme Ultraviolet Second Harmonic Generation Spectroscopy in a Polar Metal. Nano Lett. 21 (14), 6095-6101, DOI: https://doi.org/10.1021/acs.nanolett.1c01502 (2021).
Buabthong, P., Evans, J., Rinaldi, K., Kennedy, K., Fu, H., Ifkovits, Z., Kuo, T.-J., Brunschwig, B., Lewis, N. GaAs Microisland Anodes Protected by Amorphous TiO2 Films Mitigate Corrosion Spreading During Water Oxidation in Alkaline Electrolytes., ACS Energy Lett., 6, DOI: https://doi.org/10.1021/acsenergylett.1c01174 (2021).
Buckley, A., Cheng, T., Oh, M., Su, G., Garrison, J., Utan, S., Zhu, C., Toste, D., Goddard, W., Toma, F. Approaching 100% Selectivity at Low Potential on Ag for Electrochemical CO2 Reduction to CO Using a Surface Additive., ACS Catal. 11(15), 9034-9042, DOI: https://doi.org/10.1021/acscatal.1c00830 (2021).
Bui, J. C., Kim, C., Weber, A., Bell, A. Dynamic Boundary Layer Simulation of Pulsed CO2 Electrolysis on a Copper Catalyst. ACS Energy Lett., 6, https://doi.org/10.1021/acsenergylett.1c00364 (2021).
Cooper, J., Zhang, Z., Roychoudhury, S., jjiang, C.-M., Gul, S., Liu, Y.-S., Dhall, R., Ceballos, A., Yano, J., Prendergast, D., Reyes-Lillo, S. E. CuBi2O4: Electronic Structure, Optical Properties, and Photoelectrochemical Performance Limitations of the Photocathode., Chemm. Mater., 33 (3), 934-945, https://doi.org/10.1021/acs.chemmater.0c03930 (2021).
Corson, E. R., Creel, E., Kostecki, R., Urban, J., McCloskey, B. D. Effect of pressure and temperature on carbon dioxide reduction at a plasmonically active silver cathode. Electrochimica Acta, 374, 137820, https://doi.org/10.1016/j.electacta.2021.137820 (2021).
Desai, D., Zviazhynski, B., Zhou, J., Bernardi, M. Magnetotransport in semiconductors and two-dimensional materials from first principles. Phys. Pev. B 103, L161103, DOI: https://doi.org/10.1103/PhysRevB.103.L161103 (2021).
Eichhorn, J., Jiang, C.-M., Cooper, J., Sharp, I., Toma, F. Nanoscale Heterogeneities and Composition–Reactivity Relationships in Copper Vanadate Photoanodes. ACS Appl. Mater. Interfacesm 13(20), 23575-23583, DOI: https://doi.org/10.1021/acsami.1c01848 (2021).
Finke, C., Leandri, H., Karumb, E. T., Zheng, D., Hoffmann, M., Fromer, N. Economically advantageous pathways for reducing greenhouse gas emissions from industrial hydrogen under common, current economic conditions. Energy Environ. Sci., https://doi.org/10.1039/D0EE03768K (2021).
Guerrero Vela, P., Polk, J., Richter, M., Lopez Ortega, A. Dynamic thermal behavior of polycrystalline LaB6 hollow cathodes., J. Appl. Phys. 130, 083303, DOI: https://doi.org/10.1063/5.0058607 (2021).
Houle, F., Miles, R., Pollak, C., Reid, J. A purely kinetic description of the evaporation of water droplets., J. Chem. Phys., 154 (5), 054501, https://doi.org/10.1063/5.0037967 (2021).
Ifkovits, Z., Evans, J., Meier, M., Papadantonakis, K., Lewis, N. Decoupled electrochemical water-splitting systems: a review and perspective., Energy Environ. Sci., 14, 4740-4759, DOI: DOI https://doi.org/10.1039/D1EE01226F (2021).
Jiang, H., Tao, X., Kammler, M., Ding, F., Wodtke, A., Kandratsenka, A., Miller, T., Bunermann, O. Small Nuclear Quantum Effects in Scattering of H and D from Graphene. Phys. Chem. Lett., 12 (7), 1991–1996, https://doi.org/10.1021/acs.jpclett.0c02933 (2021).
Jiang, S., Link, A., Canning, D., Fooks, J. et al. Enhancing positron production using front surface target structures., Applied Physics Letters, 118 (9), 094101, https://doi.org/10.1063/5.0038222 (2021).
Kennedy, K. M., Kempler, P. A., Caban-Acevedo, M., Papadantonakis, K., Lewis, N. S. Primary Corrosion Processes for Polymer-Embedded Free-Standing or Substrate-Supported Silicon Microwire Arrays in Aqueous Alkaline Electrolytes. Nano. Lett., 21 (2), 1056-1061, https://doi.org/10.1021/acs.nanolett.0c04298 (2021).
Kim, C., Cho, K., Park, K., Kim, J., Yun, G., Toma, F., Gereige, I., Jung, H. Cu/Cu2O Interconnected Porous Aerogel Catalyst for Highly Productive Electrosynthesis of Ethanol from CO2. Advanced Functional Materials, DOI: https://doi.org/10.1002/adfm.202102142 (2021).
Kistler, T., Um, M., Cooper, J., Sharp, I., Agbo, P. Monolithic Photoelectrochemical CO2 Reduction Producing Syngas at 10% Efficiency. Advanced Energy Materials, DOI: https://doi.org/10.1002/aenm.202100070 (2021).
Koshy, D., Nathan, S., Asundi, A., Abdellah, A., Dull, S., Cullen, D., Higgins, D., Bao, Z., Bent, S., Jaramillo, T. Bridging Thermal Catalysis and Electrocatalysis: Catalyzing CO2 Conversion with Carbon-Based Materials. Angewandte Chemie, DOI: https://doi.org/10.1002/anie.202101326 (2021).
Kwon, S., Kim, Y.-G., Baricuatro, J., Goddard, W. 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 Catal, 11(19), 12068-12074, DOI: https://doi.org/10.1021/acscatal.1c02844 (2021).
Landers, A., koshy, D., Lee, S., Drisdell, W., Davis, R., Hahn, C., Mehta, A., Jaramillo, T. A refraction correction for buried interfaces applied to in situ grazing-incidence X-ray diffraction studies on Pd electrodes. J. Synchrotron Rad., 28, 919-923, DOI: https://doi.org/10.1107/S1600577521001557 (2021).
Landers, A., Peng, H., Koshy, D., Lee, S. H., Feaster, J., Lin, J., Beeman, J., Higgins, D., Yano, J., Drisdell, W., Davis, R., Bajdich, M., Abild-Pedersen, F., Mehta, A., Jaramillo, T., Hahn, C. Dynamics and Hysteresis of Hydrogen Intercalation and Deintercalation in Palladium Electrodes: A Multimodal In Situ X-ray Diffraction, Coulometry, and Computational Study. Chem. Mater., 33(15), 5872-5884, DOI: https://doi.org/10.1021/acs.chemmater.1c00291 (2021).
Lee, N., Chen, H., Zhou, J., Bernardi, M. Facile ab initio approach for self-localized polarons from canonical transformations. Phys. Rev. Materials 5, 063805, DOI: https://doi.org/10.1103/PhysRevMaterials.5.063805 (2021).
Li, R., Cheng, W., Richter, M., DuChene, J., Tian, W., Li, C., Atwater, H. Unassisted Highly Selective Gas-Phase CO2 Reduction with a Plasmonic Au/p-GaN Photocatalyst Using H2O as an Electron Donor. ACS Energy Lett. 6(5), 1849-1856, DOI: https://doi.org/10.1021/acsenergylett.1c00392 (2021).
Li, H., Yu, P., Lei, R., Yang, F., Wen, P., Ma, X., Zeng, G., Guo, J., Toma, F..M., Qiu, Y., Geyer, S..M., Wang, X., Cheng, T. and Drisdell, W. (2021), Facet-selective deposition of ultrathin Al2O3 on copper nanocrystals for highly stable CO2 electroreduction to ethylene. Angew. Chem. Int. Ed., DOI: https://doi.org/10.1002/anie.202109600 (2021).
Lindley, S., An, Q., Goddard, W., Cooper, J. Spatiotemporal Temperature and Pressure in Thermoplasmonic Gold Nanosphere–Water Systems. ACS Nano, https://doi.org/10.1021/acsnano.0c09804 (2021).
Liu, G., Lee, M., Kwon, S., Zeng, G., Eichhorn, J., Bucklet, A., Toste, D., Goddard, W., Toma, F. CO2 reduction on pure Cu produces only H2 after subsurface O is depleted: Theory and experiment. PNAS, 118 (23), e2012649118, DOI: https://doi.org/10.1073/pnas.2012649118 (2021).
Liu, Y., Qiu, H., Li, J., Guo, L., Ager, J. Tandem Electrocatalytic CO2 Reduction with Efficient Intermediate Conversion over Pyramid-Textured Cu–Ag Catalysts. ACS Appl. Mater. Interfaces 13(34), 40513-40521, DOI: https://doi.org/10.1021/acsami.1c08688 (2021).
Molina-Ruiz, M., Rosen, J., Jacks, H. C., Abernathy, M. R., Metcalf, T. H., Liu, X., DuBois, J. L., Hellman, F. Origin of mechanical and dielectric losses from two-level systems in amorphous silicon. Phys. Rev. Materials, 5, 035601, https://doi.org/10.1103/PhysRevMaterials.5.035601 (2021).
Nishimura, Y., Peng, H.-J., Nitopi, S., Bajdich, M., Wang, L., Morales-Guio, G., Abild-Pedersen, F., Jaramillo, T., Hahn, C. Guiding the Catalytic Properties of Copper for Electrochemical CO2 Reduction by Metal Atom Decoration., ACS Appl. Mater. Interfaces, DOI: https://doi.org/10.1021/acsami.1c09128 (2021).
Nunez, P., Caban-Acevedo, M., Yu, W., Richter, M., Kennedy, K., Villarino, A., Brunschwig, B., Lewis, N. Origin of the Electrical Barrier in Electrolessly Deposited Platinum Nanoparticles on p-Si Surfaces. J. Phys. Chem. C, 125(32), 17660-17670, DOI: https://doi.org/10.1021/acs.jpcc.1c03072 (2021).
Otto, L., Gaulding, A., Chen, C., Kuykendall, T., Hammack, A., Toma, F., Ogletree, F., Aloni, S., Stadler, J., Schwartzberg, A. Methods for tuning plasmonic and photonic optical resonances in high surface area porous electrodes. Nature Scientific Reports, 11, 7656, DOI: https://doi.org/10.1038/s41598-021-86813-y (2021).
Ozden, A., Wang, Y., Li, F., Luo, M., Sisler, J., Thevenon, A., Rosas-Hernandez, A., Burdyny, T., Lum, Y., Yedegari, H., Gapie, T., Peters, J., Sargent, E., Sinton, D. Cascade CO2 electroreduction enables efficient carbonate-free production of ethylene. Joule, 5(3), 706-719, https://doi.org/10.1016/j.joule.2021.01.007 (2021).
Peng, H., Tang, M., Liu, X., Lamoureux, F. S., Bajdich, M., Abild-Pedersen, F. The role of atomic carbon in directing electrochemical CO(2) reduction to multicarbon products. Energy Environ. Sci., 14, 473-482, https://doi.org/10.1039/D0EE02826F (2021).
Richter, M., Cheng, W.-H., Crumlin, E., Drisdell, W., Atwater, H. A., Schmeiser, D., Lewis, N., Brunschwig, B. S. X-ray Photoelectron Spectroscopy and Resonant X-ray Spectroscopy Investigations of Interactions between Thin Metal Catalyst Films and Amorphous Titanium Dioxide Photoelectrode Protection Layers. Chem. Mater., 33 (4), 1265-1275, https://doi.org/10.1021/acs.chemmater.0c04043 (2021).
Richter, M., Peterson, E., Zhou, L., Shinde, A., Newhouse, P., Yan, Q., Fackler, S., Yano, J., Cooper, J., Persson, K. Band Edge Energy Tuning through Electronic Character Hybridization in Ternary Metal Vanadates., Chem. Mater., 33(18), 7242-7253, DOI: https://doi.org/10.1021/acs.chemmater.1c01415 (2021).
Schwartz, G., Raj, S., Jamnuch, S., et al., Angstrom-Resolved Interfacial Structure in Buried Organic-Inorganic Junctions., Phys. Rev. Lett., 12, 096801, DOI: https://doi.org/10.1103/PhysRevLett.127.096801 (2021).
Shi, Y., Ilic, O., Atwater, H., Greer, J. All-day fresh water harvesting by microstructured hydrogel membranes. Nature Communications, 12, 2797, DOI: https://doi.org/10.1038/s41467-021-23174-0 (2021).
Soniat, M., Dischinger, S., Weng, L.-C., Beltran, H. M., Weber, A. Z., Miller, D. J., Houle, F. A. Toward predictive permeabilities: Experimental measurements and multiscale simulation of methanol transport in Nafion., J. Polym Sci., 1– 20, https://doi.org/10.1002/pol.20200771 (2021).
Thevenon, A., Rosas-Hernandez, A., Herros, A., Agapie, T., Peters, J. Dramatic HER Suppression on Ag Electrodes via Molecular Films for Highly Selective CO2 to CO Reduction. ACS Catal., 11(8), 4530-4537, DOI: https://doi.org/10.1021/acscatal.1c00338 (2021).
Wang, J., Cheng, T., Fenwick, A., Baroud, T., Rosas-Hernandez, A., Ko, J. H., Gan, Q., Goddard, W. A., Grubbs, R. H. Selective CO2 Electrochemical Reduction Enabled by a Tricomponent Copolymer Modifier on a Copper Surface. J. Am. Chem. Soc., 143 (7), 2857–2865, https://doi.org/10.1021/jacs.0c12478 (2021).
Wang, L., Peng, H., Lamaison, S., Qi, Z., Koshy, D., Stevens, M., Wakerley, D., Zeledon, J., King, L., Zhou, L., Lai, Y., Fontecave, M., Gregoire, J., Abild-Pedersen, F., Jaramillo, T., Hahn, C. Bimetallic effects on Zn-Cu electrocatalysts enhance activity and selectivity for the conversion of CO2 to CO. Chem Catalysis, DOI: https://doi.org/10.1016/j.checat.2021.05.006 (2021).
Wen, Y., Chen, P., Wang, L., Li, S., Wang, Z., Abed, J., Mao, X., Min, Y., Dinh, C., Luna, P., Huang, R., Zhang, L., Wang, L., Wang, L., Nielsen, R., Li, H. Zhuang, T., Ke, O., Voznyy, O., Hu, Y., Li, Y., Goddard, W., Zhang, B., Peng, H., Sargent, E. Stabilizing Highly Active Ru Sites by Suppressing Lattice Oxygen Participation in Acidic Water Oxidation. J. Am. Chem. Soc. 143 (17), 6482-6490, DOI: https://doi.org/10.1021/jacs.1c00384 (2021).
Yang, L., Haber, J., Amstrong, Z., Yang, S., Kan, K., Zhou, L., Richter, M., Roat, C., Wagner, N., Coram, M., Berndl, M., Riley, P., Gregoire, J. Discovery of complex oxides via automated experiments and data science., PNAS, 118(37, e2106042118, DOI: https://doi.org/10.1073/pnas.2106042118 (2021).
Ye, Y., Su, H., Lee, K., Larson, D., Valero-Vidal, C., Blum, M. A., Yano, J., Crumlin, E. Carbon Dioxide adsorption and activation on Gallium Phosphide surface monitored by ambient pressure X-ray photoelectron spectroscopy. J. Phys. D: Applied Physics, http://iopscience.iop.org/article/10.1088/1361-6463/abec0a (2021).
Yu, W., Richter, M., Simonaoff, E., Brunschwig, B., Lewis, N. Investigations of the Stability of GaAs for Photoelectrochemical H2 Evolution in Acidic or Alkaline Aqueous Electrolytes., J. Mater. Chem. A, DOI: DOI https://doi.org/10.1039/D1TA04145B (2021).
Zhou, J., Park, J., Lu, I., Maliyov, I., Tong, X., Bernardi, M. Perturbo: A software package for ab initio electron–phonon interactions, charge transport and ultrafast dynamics. Computer Physics Communications, 264, 107970, DOI: https://doi.org/10.1016/j.cpc.2021.107970 (2021).
Zhou, Y., Gao, G., Chu, W., Wang, L. Transition-metal single atoms embedded into defective BC3 as efficient electrocatalysts for oxygen evolution and reduction reactions. Nanoscale, 13(2), 1331-1339, DOI: https://doi.org/10.1039/D0NR07580A (2021).
Zhou, Y. Li, J., Gao, X., Chu, W., Gao, G., Wang, L.-W. Recent advances in single-atom electrocatalysts supported on two-dimensional materials for the oxygen evolution reaction. J. Mater. Chem. A, 9, 9979-9999, DOI: https://doi.org/10.1039/D1TA00154J (2021).
+ 2020
Agbo, P. Transparent Dual-Conductivity Membrane Composites as Current Distributors for Diffuse Electrocatalysts. ACS Appl. Energy Mater. DOI: 10.1021/acsaem.0c02339 (2020).
Agbo, P. J–V Decoupling: Independent Control over Current and Potential in Electrocatalysis. J. Phys. Chem. C, 124 (52), 28387–28394, https://doi.org/10.1021/acs.jpcc.0c08142 (2020).
Babbe, F., Sutter-Fella, C. Optical Absorption‐Based In Situ Characterization of Halide Perovskites. Advanced Energy Materials, DOI: 10.1002/aenm.201903587 (2020).
Babbe, F., Masquelier, E., Zheng, Z., Sutter-Fella, C. Multi stage and illumination dependent segregation in MAPb(I,Br)3. DOI: https://doi.org/10.1117/12.2568995 (2020).
Babbe, F., Masquelier, E., Zheng, Z., Sutter-Fella, C., Flash Formation of I-Rich Clusters during Multistage Halide Segregation Studied in MAPbI1.5Br1.5. J. Phys. Chem. C, 124, 45, 24608–24615, DOI: 10.1021/acs.jpcc.0c07063 (2020).
Baricuatro, J., Kim, Y.-G., Korzeniewski, C., Soriaga, M. 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, DOI: https://doi.org/10.1016/j.cattod.2020.01.028 (2020).
Borgwardt, M., Mahl, J., Roth, F., Wenthaus, L., Brausche, F., Blum, M., Schwarzburg, K., Liu, G., Toma, F., Gerssner, O. Photoinduced Charge Carrier Dynamics and Electron Injection Efficiencies in Au Nanoparticle-Sensitized TiO2 Determined with Picosecond Time-Resolved X-ray Photoelectron Spectroscopy. J. Phys. Chem. Lett., 11(14), 5476, DOI: https://doi.org/10.1021/acs.jpclett.0c00825 (2020).
Buabthong, P., Ifkovits, Z., Kempler, P., Chen, Y., Nunez, P., Brunschwig, B., Papadantonakis, K., Lewis, N. Failure modes of protection layers produced by atomic layer deposition of amorphous TiO2 on GaAs anodes. Energy Environ. Sci., https://doi.org/10.1039/D0EE02032J (2020).
Bui, J., Digdaya, I., Xiang, C., Bell, A., Weber, A. Understanding Multi-Ion Transport Mechanisms in Bipolar Membranes. ACS Appl. Mater. Interfaces, 12, 47, 52509–52526, DOI: 10.1021/acsami.0c12686 (2020).
Chapovetsky, A., Liu, J., Welborn, M., Luna, J., Do, T., Haiges, R., Miller, T., Marinescu, S. Electronically Modified Cobalt Aminopyridine Complexes Reveal an Orthogonal Axis for Catalytic Optimization for CO2 Reduction, Inorg. Chem., 59(18), 13709-13718, DOI: 10.1021/acs.inorgchem.0c02086 (2020).
Chen, Y. Bai, Y., Zhao, W., Ament, S., Gregoire, J., Gomes, C. Deep Reasoning Networks for Unsupervised Pattern De-mixing with Constraint Reasoning. Proceedings of the 37th International Conference on Machine Learning, PMLR 119:1500-1509, http://proceedings.mlr.press/v119/chen20a.html (2020).
Chen, Y., Cheng, T., Goddard, W. Atomistic Explanation of the Dramatically Improved Oxygen Reduction Reaction of Jagged Platinum Nanowires, 50 Times Better than Pt. J. Am. Chem. Soc. DOI: https://doi.org/10.1021/jacs.9b13218 (2020).
Chen, Y., Xiang, C., Lewis, N. Modeling the Performance of A Flow-Through Gas Diffusion Electrode for Electrochemical Reduction of CO or CO2. J. Electrochemical Society, DOI: http://iopscience.iop.org/10.1149/1945-7111/ab987a (2020).
Cheng, W.-H., Richter, M., Sullivan, I., Larson, D., Xiang, C., Brunschwig, B., Atwater, H. CO2 Reduction to CO with 19% Efficiency in a Solar-Driven Gas Diffusion Electrode Flow Cell under Outdoor Solar Illumination. ACS Energy Lett., DOI: 10.1021/acsenergylett.9b02576 (2020).
Chiu, Y.-H., Lindley, S., Tsao, C.-W., Kuo, M.-Y., Cooper, J., Hsu, Y.-J., Zhang, J. Z., Hollow Au Nanosphere-Cu2O Core-Shell Nanostructures with Controllable Core Surface Morphology. J. Phys. Chem. C DOI: https://doi.org/10.1021/acs.jpcc.0c02214 (2020).
Choi, C., Kwon, S., Cheng, T., Xu, M., Tieu, P., Lee, C., Cai, J., Lee, H., Pan, X., Duan, X., Goddard, W., and Huang, Y. Highly active and stable stepped Cu surface for enhanced electrochemical CO2 reduction to C2H4, Nature Catalysis, https://doi.org/10.1038/s41929-020-00504-x (2020).
Corson, E., Creel, E., Kostecki, R., McCloskey, B., Urban, J. Important Considerations in Plasmon-Enhanced Electrochemical Conversion at Voltage-Biased Electrodes. Science, 23(3), 100911 DOI: 10.1016/j.isci.2020.100911 (2020).
Corson, E., Kas, R., Kostecki, R., Urban, J., Smith, W., McCloskey, B., Kortlever, R. In Situ ATR–SEIRAS of Carbon Dioxide Reduction at a Plasmonic Silver Cathode. J. Am. Chem. Soc. DOI: https://doi.org/10.1021/jacs.0c01953 (2020).
Corson, E., Subramani, A., Cooper, J., Kostecki, R., Urban, J., McCloskey, B. Reduction of Carbon Dioxide at a Plasmonically Active Copper-Silver Cathode. Chem. Commun., DOI: https://doi.org/10.1039/D0CC03215H (2020).
Digdaya, I., Sullivan, I., Lin, M., Han, L., Cheng, W.-H., Atwater, H., Xiang, C. A direct coupled electrochemical system for capture and conversion of CO2 from oceanwater, Nature Communications, 11, 4412, DOI: https://doi.org/10.1038/s41467-020-18232-y (2020).
De Riccardis, A., Lee, M., Kazantsev, R., Garza, A., Zeng, G., Larson, D., Clark, E., Labaccaro, P., Burroughs, P., Bloise, E., Ager, J., Bell, A., Head-Gordon, M., Mele, G., Toma, F. Heterogenized Pyridine-Substituted Cobalt (II) Phthalocyanine Yeilds Reduction of CO2 by Tuning the Electron Affinity of the Co Center. ACS Appl. Mater. Interfaces, 12 (5), 5251, DOI: https://doi.org/10.1021/acsami.9b18924 (2020).
DuChene, J., Tagliabue, G., Welch, A., Li, X., Cheng, W.-H., Atwater, H. Optical Excitation of a Nanoparticle Cu/p-NiO Photocathode Improves Reaction Selectivity for CO2 Reduction in Aqueous Electrolytes. Nano Lett., DOI: 10.1021/acs.nanolett.9b04895 (2020).
Ebaid, M., Jiang, K., Zhang, Z., Drisdell, W., Bell, A., Cooper, J. Production of C2/C3 Oxygenates from Planar Copper Nitride-Derived Mesoporous Copper via Electrochemical Reduction of CO2. Chem. Mater., DOI: 10.1021/acs.chemmater.0c00761 (2020).
Ebaid, M., Larson, D., Bustillo, K., Turner, J., Cooper, J. Saw-Tooth Heat-Cycling Nitridation of Metallic Cu Yields First Photoactive p-Cu3N for PEC Applications. ACS Appl. Energy Mater. 3, 11, 10714–10721, DOI: 10.1021/acsaem.0c01754 (2020).
Eichhorn, J., Reyes-Lillo, S., Roychoudhury, S., Sallis, S., Weis, J., Larson, D., Cooper, J., Sharp, I., Prendergast, D., Toma, F. Revealing Nanoscale Chemical Heterogeneities in Polycrystalline Mo‐BiVO4 Thin Films. Small, 2001600., DOI: https://doi.org/10.1002/smll.202001600 (2020).
Ferrah, D., Tieu, P. Controllable Growth of Copper on TiO2 Nanoparticles by Photodeposition Based on Coupled Effects of Solution Viscosity and Photoreduction Rate for Catalysis-Related Applications. ACS Appl.Nano Mater., 3(6), 5855, DOI: https://doi.org/10.1021/acsanm.0c01015 (2020).
Flores Espinosa, M., Cheng, T., Xu, M., Abatemarco, L., Choi, C., Pan, X., Goddard, W., Zhao, Z., Huang, Y. Compressed Intermetallic PdCu for Enhanced Electrocatalysis. ACS Energy Lett., 5, 3672–3680, DOI: 10.1021/acsenergylett.0c01959 (2020).
Fu, J.-H., Lu, A.-Y., Madden, N., Wu, C., Chen, Y.-C., Chiu, M.-H., Hattar, K., Krogstad, J., Chou, S., Li, L.-J., Kong, J., Tung, V. Additive manufacturing assisted van der Waals integration of 3D/3D hierarchically functional nanostructures. Comm. Materials, 1, DOI: https://doi.org/10.1038/s43246-020-0041-2 (2020).
Fu, J.-H., Moreno-Hernandez, I., Buabthong, P., Papadantonakis, K., Brunschwig, B., Lewis, N. Enhanced Stability of Silicon for Photoelectrochemical Water Oxidation Through Self-Healing Enabled by an Alkaline Protective Electrolyte. Energy.Environ. Sci., https://doi.org/10.1039/D0EE02250K (2020).
Gai, Y., Tang, G., Gao, G., Wang, L.-W. Thermodynamic Full Landscape Searching Scheme for Identifying the Mechanism of Electrochemical Reaction: A Case Study of Oxygen Evolution on Fe- and Co-Doped Graphene–Nitrogen Sites. J. Phys. Chem. A, DOI: https://doi.org/10.1021/acs.jpca.0c02449 (2020).
Garg, S., Li, M., Weber, A., Ge, L., Li, L., Rudolph, V., Wang, G., Rufford, T. Advances and challenges in electrochemical CO2 reduction processes: an engineering and design perspective looking beyond new catalyst materials. J. Mater. Chem. A, 8, 1511-1544, DOI: https://doi.org/10.1039/C9TA13298H (2020).
Gauthier, J., Chen., L., Bajdich, M., Chan, K. Implications of the fractional charge of hydroxide at the electrochemical interface. Phys. Chem. Chem. Phys., DOI: 10.1039/C9CP05952K (2020).
Ge, L., Yuan, H., Min, Y., Li, L., Chen, S., Xu, L., Goddard, W. Predicted Optimal Bifunctional Electrocatalysts for Both HER and OER Using Chalcogenide Heterostructures Based on Machine Learning Analysis of In Silico Quantum Mechanics Based High Throughput Screening. J. Phys. Chem. Lett., DOI: 10.1021/acs.jpclett.9b03875 (2020).
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Chen, S. Y. & Wang, L. W. Intrinsic defects and electronic conductivity of TaON: First-principles insights. Applied Physics Letters 99, 222103, DOI: 10.1063/1.3664346 (2011).
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