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A DOE Energy Frontier Research Center
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Title
Cited by
Cited by
Year
E (3)-equivariant graph neural networks for data-efficient and accurate interatomic potentials
S Batzner, A Musaelian, L Sun, M Geiger, JP Mailoa, M Kornbluth, ...
Nature communications 13 (1), 1-11, 2022
7732022
Single-atom alloy catalysis
RT Hannagan, G Giannakakis, M Flytzani-Stephanopoulos, ECH Sykes
Chemical Reviews 120 (21), 12044-12088, 2020
6102020
Pt/Cu single-atom alloys as coke-resistant catalysts for efficient C–H activation
MD Marcinkowski, MT Darby, J Liu, JM Wimble, FR Lucci, S Lee, ...
Nature chemistry 10 (3), 325-332, 2018
5212018
O2 Activation by Metal Surfaces: Implications for Bonding and Reactivity on Heterogeneous Catalysts
MM Montemore, MA van Spronsen, RJ Madix, CM Friend
Chemical reviews 118 (5), 2816-2862, 2017
4032017
Heterogeneous catalysis: a central science for a sustainable future
CM Friend, B Xu
Accounts of chemical research 50 (3), 517-521, 2017
3592017
Atomic-scale observations of catalyst structures under reaction conditions and during catalysis
F Tao, PA Crozier
Chemical reviews 116 (6), 3487-3539, 2016
2982016
Dynamic restructuring drives catalytic activity on nanoporous gold–silver alloy catalysts
B Zugic, L Wang, C Heine, DN Zakharov, BAJ Lechner, EA Stach, ...
Nature materials 16 (5), 558-564, 2017
2682017
On-the-fly active learning of interpretable Bayesian force fields for atomistic rare events
J Vandermause, SB Torrisi, S Batzner, Y Xie, L Sun, AM Kolpak, ...
npj Computational Materials 6 (1), 1-11, 2020
2562020
Rh single atoms on TiO 2 dynamically respond to reaction conditions by adapting their site
Y Tang, C Asokan, M Xu, GW Graham, X Pan, P Christopher, J Li, ...
Nature communications 10 (1), 1-10, 2019
2162019
Single Nickel Atoms Anchored on Nitrogen-Doped Graphene as a Highly Active Cocatalyst for Photocatalytic H2 Evolution
Q Zhao, J Sun, S Li, C Huang, W Yao, W Chen, T Zeng, Q Wu, Q Xu
ACS Catalysis 8 (12), 11863-11874, 2018
1872018
Elucidating the stability and reactivity of surface intermediates on single-atom alloy catalysts
MT Darby, R Réocreux, ECH Sykes, A Michaelides, M Stamatakis
ACS Catalysis 8 (6), 5038-5050, 2018
1692018
Nanoporous gold: understanding the origin of the reactivity of a 21st century catalyst made by pre-Columbian technology
J Biener, MM Biener, RJ Madix, CM Friend
Acs catalysis 5 (11), 6263-6270, 2015
1652015
Toward digitally controlled catalyst architectures: Hierarchical nanoporous gold via 3D printing
C Zhu, Z Qi, VA Beck, M Luneau, J Lattimer, W Chen, MA Worsley, J Ye, ...
Science advances 4 (8), eaas9459, 2018
1642018
Recycling of CO2: Probing the Chemical State of the Ni(111) Surface during the Methanation Reaction with Ambient-Pressure X-Ray Photoelectron Spectroscopy
C Heine, BAJ Lechner, H Bluhm, M Salmeron
Journal of the American Chemical Society 138 (40), 13246-13252, 2016
1632016
Guidelines to achieving high selectivity for the hydrogenation of α, β-unsaturated aldehydes with bimetallic and dilute alloy catalysts: A review
M Luneau, JS Lim, DA Patel, ECH Sykes, CM Friend, P Sautet
Chemical reviews 120 (23), 12834-12872, 2020
1562020
NiCu single atom alloys catalyze the CH bond activation in the selective non-oxidative ethanol dehydrogenation reaction
J Shan, J Liu, M Li, S Lustig, S Lee, M Flytzani-Stephanopoulos
Applied Catalysis B: Environmental 226, 534-543, 2018
1552018
Selective non-oxidative dehydrogenation of ethanol to acetaldehyde and hydrogen on highly dilute NiCu alloys
J Shan, N Janvelyan, H Li, J Liu, TM Egle, J Ye, MM Biener, J Biener, ...
Applied Catalysis B: Environmental 205, 541-550, 2017
1472017
Nanoporous metals with structural hierarchy: A review
T Juarez, J Biener, J Weissmüller, AM Hodge
Advanced Engineering Materials 19 (12), 1700389, 2017
1322017
Palladium–gold single atom alloy catalysts for liquid phase selective hydrogenation of 1-hexyne
J Liu, J Shan, FR Lucci, S Cao, ECH Sykes, M Flytzani-Stephanopoulos
Catalysis Science & Technology 7 (19), 4276-4284, 2017
1232017
Enhancing the hydrogen activation reactivity of nonprecious metal substrates via confined catalysis underneath graphene
Y Zhou, W Chen, P Cui, J Zeng, Z Lin, E Kaxiras, Z Zhang
Nano Letters 16 (10), 6058-6063, 2016
1152016
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