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Nicole Kirchner-Hall
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Extensive benchmarking of DFT+ calculations for predicting band gaps
NE Kirchner-Hall, W Zhao, Y Xiong, I Timrov, I Dabo
Applied Sciences 11 (5), 2395, 2021
942021
Optimizing accuracy and efficacy in data-driven materials discovery for the solar production of hydrogen
Y Xiong, QT Campbell, J Fanghanel, CK Badding, H Wang, ...
Energy & Environmental Science, 2021
342021
Understanding the Photoelectrochemical Properties of Theoretically Predicted Water‐Splitting Catalysts for Effective Materials Discovery
RR Katzbaer, MJ Theibault, NE Kirchner‐Hall, Z Mao, I Dabo, HD Abruña, ...
Advanced Energy Materials 12 (46), 2201869, 2022
92022
Ternary Oxides of - and -Block Metals for Photocatalytic Solar-to-Hydrogen Conversion
S Gelin, NE Kirchner-Hall, RR Katzbaer, MJ Theibault, Y Xiong, W Zhao, ...
PRX Energy 3 (1), 013007, 2024
32024
Process development for adjustable X-ray mirrors
M Tendulkar, T Liu, N Kirchner-Hall, N Bishop, Q Tran, CT DeRoo, ...
Optics for EUV, X-Ray, and Gamma-Ray Astronomy X 11822, 198-205, 2021
22021
Ternary Oxides of Pre-and Post-Transition Metals for Photocatalytic Solar-to-Hydrogen Conversion
S Gelin, N Kirchner-Hall, R Katzbaer, M Theibault, Y Xiong, M Cococcioni, ...
APS March Meeting Abstracts 2023, M45. 005, 2023
2023
Correction: Optimizing accuracy and efficacy in data-driven materials discovery for the solar production of hydrogen
Y Xiong, QT Campbell, J Fanghanel, CK Badding, H Wang, ...
Energy & Environmental Science 15 (4), 1695-1695, 2022
2022
Determining Schottky barrier heights of 2D GaSe and GaTe with various metals for improved solar cells
J Koehl, NE Kirchner-Hall, I Dabo
Bulletin of the American Physical Society, 2021
2021
Unpinning the relationship between pinning factor and electronegativity by calculating Schottky barrier heights from first principles
N Kirchner-Hall, I Dabo
Bulletin of the American Physical Society 65, 2020
2020
Electronic Supplementary Information (ESI): Optimizing accuracy and efficacy in data-driven materials discovery for the solar production of hydrogen
Y Xiong, QT Campbell, J Fanghanel, CK Badding, H Wang, ...
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