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Graphdiyne-Supported Single Iron Atom: A Promising Electrocatalyst for Carbon Dioxide Electroreduction into Methane and Ethanol

Liu, X., Wang, Z., Tian, Y., & Zhao, J. (2020) · The Journal of Physical Chemistry C · doi:10.1021/acs.jpcc.9b11649 · Cited by 108 · see citing works

Charge-regulated CO2 capture capacity of metal atom embedded graphyne: A first-principles study

He, C., Wang, R., Xiang, D., Li, X., Fu, L., Jian, Z., Huo, J., & Li, S. (2020) · Applied Surface Science · doi:10.1016/j.apsusc.2020.145392 · Cited by 104 · see citing works

Computational Screening of Near-Surface Alloys for CO2 Electroreduction

Zhao, Z., & Lü, G. (2018) · ACS Catalysis · doi:10.1021/acscatal.7b03705 · Cited by 102 · see citing works

Microkinetic Analysis and Scaling Relations for Catalyst Design

Motagamwala, A. H., Ball, M. R., & Dumesic, J. A. (2018) · Annual Review of Chemical and Biomolecular Engineering · doi:10.1146/annurev-chembioeng-060817-084103 · Cited by 103 · see citing works

How can the Dual‐atom Catalyst FeCo–NC Surpass Single‐atom Catalysts Fe–NC/Co–NC in CO2RR? – CO Intermediate Assisted Promotion via a Synergistic Effect

Cao, S., Zhou, S., Chen, H., Wei, S., Liu, S., Lin, X., Chen, X., Wang, Z., Guo, W., & Lü, X. (2021) · Energy & environment materials · doi:10.1002/eem2.12287 · Cited by 99 · see citing works

The adsorption characteristics of As2O3, Pb0, PbO and PbCl2 on single atom iron adsorbent with graphene-based substrates

Yang, W., Gao, Z., Liu, X., Ding, X., & Yan, W. (2018) · Chemical Engineering Journal · doi:10.1016/j.cej.2018.12.087 · Cited by 96 · see citing works

Double-atom catalysts for energy-related electrocatalysis applications: a theoretical perspective

Wu, D., He, B., Wang, Y., Lv, P., Ma, D., & Jia, Y. (2022) · Journal of Physics D Applied Physics · doi:10.1088/1361-6463/ac4b56 · Cited by 96 · see citing works

Perspective on theoretical methods and modeling relating to electro-catalysis processes

Li, Q., Ouyang, Y., Lu, S., Bai, X., Zhang, Y., Shi, L., Ling, C., & Wang, J. (2020) · Chemical Communications · doi:10.1039/d0cc02998j · Cited by 96 · see citing works

MXene-based single atom catalysts for efficient CO2RR towards CO: A novel strategy for high-throughput catalyst design and screening

Cao, S., Chen, H., Hu, Y., Li, J., Yang, C., Chen, Z., Wei, S., Liu, S., Wang, Z., Sun, D., et al. (2022) · Chemical Engineering Journal · doi:10.1016/j.cej.2023.141936 · Cited by 93 · see citing works

Cu/Cu2O Nanoparticles Supported on Vertically ZIF-L-Coated Nitrogen-Doped Graphene Nanosheets for Electroreduction of CO2 to Ethanol

Zhang, Y., Li, K., Chen, M., Wang, J., Liu, J., & Zhang, Y. (2019) · ACS Applied Nano Materials · doi:10.1021/acsanm.9b01935 · Cited by 93 · see citing works

Hybrid Metal–Boron Diatomic Site Embedded in C 2 N Monolayer Promotes C–C Coupling in CO 2 Electroreduction

He, M., An, W., Wang, Y., Men, Y., & Liu, S. (2021) · Small · doi:10.1002/smll.202104445 · Cited by 92 · see citing works

Unique copper and reduced graphene oxide nanocomposite toward the efficient electrochemical reduction of carbon dioxide

Hossain, M. N., Wen, J., & Chen, A. (2017) · Scientific Reports · doi:10.1038/s41598-017-03601-3 · Cited by 91 · see citing works

Do we achieve “1 + 1 > 2” in dual-atom or dual-single-atom catalysts?

Yang, X., Xu, L., & Li, Y. (2024) · Coordination Chemistry Reviews · doi:10.1016/j.ccr.2024.215961 · Cited by 89 · see citing works

Advances and Regulation Strategies of the Active Moiety in Dual‐Atom Site Catalysts for Efficient Electrocatalysis

Zhu, P., Xiong, X., Wang, D. S., & Li, Y. (2023) · Advanced Energy Materials · doi:10.1002/aenm.202300884 · Cited by 88 · see citing works

Insight into coupled Ni-Co dual-metal atom catalysts for efficient synergistic electrochemical CO2 reduction

Zhang, Q., Liu, D., Zhang, Y., Guo, Z., Chen, M., Chen, Y., Jin, B., Song, Y., & Pan, H. (2023) · Journal of Energy Chemistry · doi:10.1016/j.jechem.2023.08.046 · Cited by 85 · see citing works

Metal-Free Boron Nitride Nanoribbon Catalysts for Electrochemical CO2 Reduction: Combining High Activity and Selectivity

Tang, S., Zhou, X., Zhang, S., Li, X., Yang, T., Hu, W., Jiang, J., & Luo, Y. (2018) · ACS Applied Materials & Interfaces · doi:10.1021/acsami.8b18505 · Cited by 83 · see citing works

Theoretical study on double-atom catalysts supported with graphene for electroreduction of nitrogen into ammonia

Yang, W., Huang, H., Ding, X., Ding, Z., Wu, C., Gates, I. D., & Gao, Z. (2020) · Electrochimica Acta · doi:10.1016/j.electacta.2020.135667 · Cited by 83 · see citing works

Pt nanoclusters anchored on ordered macroporous nitrogen-doped carbon for accelerated water dissociation toward superior alkaline hydrogen production

Li, J., Liu, J., Chen, C., Guo, J., Bi, R., Chen, S., Zhang, L., & Zhu, M. H. (2022) · Chemical Engineering Journal · doi:10.1016/j.cej.2022.135186 · Cited by 83 · see citing works

Mechanism of electrocatalytic CO2 reduction reaction by borophene supported bimetallic catalysts

Liu, M., Balamurugan, J., Liang, T., & Liu, C. (2024) · Journal of Colloid and Interface Science · doi:10.1016/j.jcis.2024.01.051 · Cited by 83 · see citing works

Tuning precise numbers of supported nickel clusters on graphdiyne for efficient CO2 electroreduction toward various multi-carbon products

Yang, M., Wang, Z., Jiao, D., Tian, Y., Shang, Y., Yin, L., Cai, Q., & Zhao, J. (2022) · Journal of Energy Chemistry · doi:10.1016/j.jechem.2022.01.023 · Cited by 79 · see citing works

Dual metal atom catalysts: Advantages in electrocatalytic reactions

Liu, K., Li, J., Liu, Y., Wang, M., & Cui, H. (2023) · Journal of Energy Chemistry · doi:10.1016/j.jechem.2023.01.021 · Cited by 79 · see citing works

Selective CO 2 Reduction over γ-Graphyne Supported Single-Atom Catalysts: Crucial Role of Strain Regulation

Liu, T., Xu, T., Li, T., & Jing, Y. (2024) · Journal of the American Chemical Society · doi:10.1021/jacs.4c08677 · Cited by 80 · see citing works

Recent Progress in the Theoretical Investigation of Electrocatalytic Reduction of CO 2

Tian, Z., Priest, C. W., & Chen, L. (2018) · Advanced Theory and Simulations · doi:10.1002/adts.201800004 · Cited by 79 · see citing works

Syngas production from electrocatalytic CO 2 reduction with high energetic efficiency and current density

Chen, P., Jiao, Y., Zhu, Y., Chen, S., Song, L., Jaroniec, M., Zheng, Y., & Qiao, S. (2019) · Journal of Materials Chemistry A · doi:10.1039/c9ta01932d · Cited by 77 · see citing works

Leveraging Dual‐Atom Catalysts for Electrocatalysis Revitalization: Exploring the Structure‐Performance Correlation

Wong, M., Foo, J. J., Loh, J. Y., & Ong, W. (2024) · Advanced Energy Materials · doi:10.1002/aenm.202303281 · Cited by 77 · see citing works

Single transition metal atom catalysts on Ti2CN2 for efficient CO2 reduction reaction

Li, F., Ai, H., Shi, C., Lo, K. H., & Pan, H. (2021) · International Journal of Hydrogen Energy · doi:10.1016/j.ijhydene.2021.01.096 · Cited by 73 · see citing works

Advances and perspectives on heteronuclear dual-atomic catalysts for prevailing the linear scaling relationship in electrocatalytic CO2 reduction

Yasin, G., Kumar, A., Ajmal, S., Mushtaq, M. A., Tabish, M., Saad, A., Assiri, M. A., Nazir, M. T., & Zhuo, Q. (2023) · Coordination Chemistry Reviews · doi:10.1016/j.ccr.2023.215589 · Cited by 77 · see citing works

Cu atomic chains supported on β-borophene sheets for effective CO 2 electroreduction

Shen, H., Li, Y., & Sun, Q. (2018) · Nanoscale · doi:10.1039/c8nr01855c · Cited by 74 · see citing works

Transition-metal-atom-pairs deposited on g-CN monolayer for nitrogen reduction reaction: Density functional theory calculations

Huang, B., Wu, Y., Chen, B., Qian, Y., Zhou, N., & Li, N. (2021) · CHINESE JOURNAL OF CATALYSIS (CHINESE VERSION) · doi:10.1016/s1872-2067(20)63745-7 · Cited by 72 · see citing works

Emerging dual-atomic-site catalysts for electrocatalytic CO2 reduction

Qiu, N., Li, J.-J., Wang, H.-Q., & Zhang, Z.-C. (2022) · Science China Materials · doi:10.1007/s40843-022-2189-x · Cited by 54 · see citing works

Tuning the activity of N-doped carbon for CO 2 reduction via in situ encapsulation of nickel nanoparticles into nano-hybrid carbon substrates

Yuan, C., Li, H., Jiang, Y., Liang, K., Zhao, S., Fang, X.-X., Ma, L.-B., Zhao, T., Lin, C., & Xu, A. (2019) · Journal of Materials Chemistry A · doi:10.1039/c8ta11500a · Cited by 71 · see citing works

Experimental and Theoretical Advances on Single Atom and Atomic Cluster‐Decorated Low‐Dimensional Platforms towards Superior Electrocatalysts

He, T., Puente-Santiago, A. R., Xia, S., Ahsan, M., Xu, G., & Luque, R. (2022) · Advanced Energy Materials · doi:10.1002/aenm.202200493 · Cited by 54 · see citing works

Efficient Heteronuclear Diatom Electrocatalyst for Nitrogen Reduction Reaction: Pd–Nb Diatom Supported on Black Phosphorus

Zhang, Z., & Xu, X. (2020) · ACS Applied Materials & Interfaces · doi:10.1021/acsami.0c16362 · Cited by 69 · see citing works

Graphene-assisted construction of electrocatalysts for carbon dioxide reduction

Hu, H., Ou, J. Z., Xu, X., Lin, Y., Zhang, Y., Zhao, H., Chen, D., He, M., Huang, Y., & Deng, L. (2021) · Chemical Engineering Journal · doi:10.1016/j.cej.2021.130587 · Cited by 69 · see citing works

Insight on Atomically Dispersed Cu Catalysts for Electrochemical CO 2 Reduction

Wang, J., Deng, D., Wu, Q., Liu, M., Wang, Y., Jiang, J., Zheng, X., Zheng, H., Bai, Y., Chen, Y., et al. (2023) · ACS Nano · doi:10.1021/acsnano.3c07307 · Cited by 70 · see citing works

Bimetallic atomic site catalysts for CO2 reduction reactions: a review

Fu, J., Liu, K., Li, H., Hu, J., & Liu, M. (2021) · Environmental Chemistry Letters · doi:10.1007/s10311-021-01335-3 · Cited by 68 · see citing works

Strain and Ligand Effects on CO2Reduction Reactions over Cu–Metal Heterostructure Catalysts

Liu, F., Wu, C. J., & Yang, S. (2017) · The Journal of Physical Chemistry C · doi:10.1021/acs.jpcc.7b07081 · Cited by 67 · see citing works

Coordination-tuned Fe single-atom catalyst for efficient CO2 electroreduction: The power of B atom

Ren, M., Guo, X., & Huang, S. (2022) · Chemical Engineering Journal · doi:10.1016/j.cej.2021.134270 · Cited by 65 · see citing works

Titania-Modified Silver Electrocatalyst for Selective CO2 Reduction to CH3OH and CH4 from DFT Study

Zhai, L., Cui, C., Zhao, Y., Zhu, X., Han, J., Wang, H., & Ge, Q. (2017) · The Journal of Physical Chemistry C · doi:10.1021/acs.jpcc.7b03314 · Cited by 65 · see citing works

How computations accelerate electrocatalyst discovery

Ling, C., Cui, Y., Lu, S., Bai, X., & Wang, J. (2022) · Chem · doi:10.1016/j.chempr.2022.03.015 · Cited by 67 · see citing works

Trade-Off between the Coordination Environment and Active-Site Density on Fe–N x C y –C Catalysts for Enhanced Electrochemical CO 2 Reduction to CO

Wang, J., Song, Y., Chen, C., Zhao, X., & Fan, W. (2023) · ACS Catalysis · doi:10.1021/acscatal.3c04976 · Cited by 65 · see citing works

Two-Dimensional Cobaltporphyrin-based Cobalt–Organic Framework as an Efficient Photocatalyst for CO2 Reduction Reaction: A Computational Study

Wang, C., Liu, X., Zhang, M., Geng, Y., Liang, Z., Li, Y., & Su, Z. (2019) · ACS Sustainable Chemistry & Engineering · doi:10.1021/acssuschemeng.9b02699 · Cited by 65 · see citing works

Understanding trends in the activity and selectivity of bi-atom catalysts for the electrochemical reduction of carbon dioxide

Li, F., & Tang, Q. H. (2021) · Journal of Materials Chemistry A · doi:10.1039/d1ta01120k · Cited by 63 · see citing works

Theoretical investigation on electrocatalytic reduction of CO2 to methanol and methane by bimetallic atoms TM1/TM2-N@Gra (TM = Fe, Co, Ni, Cu)

Wei, X., Cao, S., Wei, S., Liu, S., Wang, Z., Dai, F., & Lü, X. (2022) · Applied Surface Science · doi:10.1016/j.apsusc.2022.153377 · Cited by 62 · see citing works

Recent Advances in Dual‐Atom Site Catalysts for Efficient Oxygen and Carbon Dioxide Electrocatalysis

An, Q., Jiang, J., Cheng, W., Su, H. D., Jiang, Y. G., & Liu, Q. (2022) · Small Methods · doi:10.1002/smtd.202200408 · Cited by 62 · see citing works

Electrocatalytic Activity and Design Principles of Heteroatom-Doped Graphene Catalysts for Oxygen-Reduction Reaction

Li, F., Shu, H., Liu, X., Shi, Z., Liang, P., & Chen, X. (2017) · The Journal of Physical Chemistry C · doi:10.1021/acs.jpcc.7b03093 · Cited by 60 · see citing works

Enhancing both selectivity and activity of CO2 conversion by breaking scaling relations with bimetallic active sites anchored in covalent organic frameworks

Gong, L., Zhang, D., Shen, Y., Wang, X., Zhang, J., Han, X., Zhang, L., & Xia, Z. (2020) · Journal of Catalysis · doi:10.1016/j.jcat.2020.07.021 · Cited by 59 · see citing works

Charge transfer and orbital reconstruction of non-noble transition metal single-atoms anchored on Ti2CT -MXenes for highly selective CO2 electrochemical reduction

Li, N., Peng, J., Shi, Z., Zhang, P., & Li, X. (2022) · CHINESE JOURNAL OF CATALYSIS (CHINESE VERSION) · doi:10.1016/s1872-2067(21)64018-4 · Cited by 59 · see citing works

Single‐atom catalysts for the electrochemical reduction of carbon dioxide into hydrocarbons and oxygenates

Gandionco, K. A., Kim, J., Bekaert, L., Hubin, A., & Lim, J. (2023) · Carbon Energy · doi:10.1002/cey2.410 · Cited by 61 · see citing works

Two-dimensional π-conjugated metal bis(dithiolene) nanosheets as promising electrocatalysts for carbon dioxide reduction: a computational study

Tian, Y., Zhu, C., Yan, L., Zhao, J., & Su, Z. (2019) · Journal of Materials Chemistry A · doi:10.1039/c9ta02271f · Cited by 59 · see citing works

Exploring the reduction reaction mechanism of CO2 on graphene-supported metal dimers using density functional theory

Zhou, J., Su, X., & Yu, Y. (2022) · Molecular Physics · doi:10.1080/00268976.2022.2096512

Graphene-Supported Monometallic and Bimetallic Dimers for Electrochemical CO2 Reduction

He, H., Morrissey, C., Curtiss, L. A., & Zapol, P. (2018) · The Journal of Physical Chemistry C · doi:10.1021/acs.jpcc.8b07887 · Cited by 36 · see citing works

Activity–Selectivity Enhancement and Catalytic Trend of CO2 Electroreduction on Metallic Dimers Supported by N-Doped Graphene: A Computational Study

Bui, H. T., Bui, V. Q., Shao, X., Kumar, A., Kim, S., Le, H. M., Kawazoe, Y., & Lee, H. (2021) · The Journal of Physical Chemistry C · doi:10.1021/acs.jpcc.1c02908 · Cited by 21 · see citing works

CO2 reduction performance of Cu/Er supported on N-doped graphene: A first principles study

Zhang, Y., Xu, W., Kumar, A., Sun, H., Cao, A., Zhang, Z., Jiang, Z., Yang, Z., Dong, J., & Li, Y. (2023) · Molecular Catalysis · doi:10.1016/j.mcat.2023.113335 · Cited by 10 · see citing works

High selective and efficient Fe2–N6 sites for CO2 electroreduction: A theoretical investigation

Meng, Y., Li, K., Xiao, D., Yuan, Y., Wang, Y., & Wu, Z. (2020) · International Journal of Hydrogen Energy · doi:10.1016/j.ijhydene.2020.03.134 · Cited by 34 · see citing works