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John M. Gregoire
John M. Gregoire
Verified email at caltech.edu - Homepage
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Cited by
Year
Lithium-assisted plastic deformation of silicon electrodes in lithium-ion batteries: a first-principles theoretical study
K Zhao, WL Wang, J Gregoire, M Pharr, Z Suo, JJ Vlassak, E Kaxiras
Nano letters 11 (7), 2962-2967, 2011
3722011
The 2019 materials by design roadmap
K Alberi, MB Nardelli, A Zakutayev, L Mitas, S Curtarolo, A Jain, M Fornari, ...
Journal of Physics D: Applied Physics 52 (1), 013001, 2018
3082018
The Evolution of the Polycrystalline Copper Surface, First to Cu(111) and Then to Cu(100), at a Fixed CO2RR Potential: A Study by Operando EC-STM
YG Kim, JH Baricuatro, A Javier, JM Gregoire, MP Soriaga
Langmuir 30 (50), 15053-15056, 2014
2812014
Fulfilling the promise of the materials genome initiative with high-throughput experimental methodologies
ML Green, CL Choi, JR Hattrick-Simpers, AM Joshi, I Takeuchi, SC Barron, ...
Applied Physics Reviews 4 (1), 2017
2722017
Inverse design of solid-state materials via a continuous representation
J Noh, J Kim, HS Stein, B Sanchez-Lengeling, JM Gregoire, ...
Matter 1 (5), 1370-1384, 2019
2622019
Electrochemical stability of metastable materials
AK Singh, L Zhou, A Shinde, SK Suram, JH Montoya, D Winston, ...
Chemistry of Materials 29 (23), 10159-10167, 2017
2072017
Solar fuels photoanode materials discovery by integrating high-throughput theory and experiment
Q Yan, J Yu, SK Suram, L Zhou, A Shinde, PF Newhouse, W Chen, G Li, ...
Proceedings of the National Academy of Sciences 114 (12), 3040-3043, 2017
1872017
Discovering Ce-rich oxygen evolution catalysts, from high throughput screening to water electrolysis
JA Haber, Y Cai, S Jung, C Xiang, S Mitrovic, J Jin, AT Bell, JM Gregoire
Energy & Environmental Science 7 (2), 682-688, 2014
1832014
Autonomous experimentation systems for materials development: A community perspective
E Stach, B DeCost, AG Kusne, J Hattrick-Simpers, KA Brown, KG Reyes, ...
Matter 4 (9), 2702-2726, 2021
1822021
Progress and prospects for accelerating materials science with automated and autonomous workflows
HS Stein, JM Gregoire
Chemical science 10 (42), 9640-9649, 2019
1632019
An Operando Investigation of (Ni–Fe–Co–Ce)Ox System as Highly Efficient Electrocatalyst for Oxygen Evolution Reaction
M Favaro, WS Drisdell, MA Marcus, JM Gregoire, EJ Crumlin, JA Haber, ...
ACS Catalysis 7 (2), 1248-1258, 2017
1602017
Analysis of the limitations in the oxygen reduction activity of transition metal oxide surfaces
H Li, S Kelly, D Guevarra, Z Wang, Y Wang, JA Haber, M Anand, ...
Nature Catalysis 4 (6), 463-468, 2021
1562021
Robust and synthesizable photocatalysts for CO2 reduction: a data-driven materials discovery
AK Singh, JH Montoya, JM Gregoire, KA Persson
Nature communications 10 (1), 443, 2019
1472019
High throughput light absorber discovery, part 1: an algorithm for automated tauc analysis
SK Suram, PF Newhouse, JM Gregoire
ACS combinatorial science 18 (11), 673-681, 2016
1422016
Scanning droplet cell for high throughput electrochemical and photoelectrochemical measurements
JM Gregoire, C Xiang, X Liu, M Marcin, J Jin
Review of Scientific Instruments 84 (2), 2013
1412013
High-throughput, combinatorial synthesis of multimetallic nanoclusters
Y Yao, Z Huang, T Li, H Wang, Y Liu, HS Stein, Y Mao, J Gao, M Jiao, ...
Proceedings of the National Academy of Sciences 117 (12), 6316-6322, 2020
1232020
Benchmarking the acceleration of materials discovery by sequential learning
B Rohr, HS Stein, D Guevarra, Y Wang, JA Haber, M Aykol, SK Suram, ...
Chemical science 11 (10), 2696-2706, 2020
1112020
Perspective: composition–structure–property mapping in high-throughput experiments: turning data into knowledge
JR Hattrick-Simpers, JM Gregoire, AG Kusne
APL Materials 4 (5), 2016
1112016
Computational sustainability: Computing for a better world and a sustainable future
C Gomes, T Dietterich, C Barrett, J Conrad, B Dilkina, S Ermon, F Fang, ...
Communications of the ACM 62 (9), 56-65, 2019
1042019
Rutile Alloys in the Mn–Sb–O System Stabilize Mn3+ To Enable Oxygen Evolution in Strong Acid
L Zhou, A Shinde, JH Montoya, A Singh, S Gul, J Yano, Y Ye, EJ Crumlin, ...
Acs Catalysis 8 (12), 10938-10948, 2018
1042018
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