Nature Catalysis, volume 5, issue 9, pages 818-831

The role of Cu1–O3 species in single-atom Cu/ZrO2 catalyst for CO2 hydrogenation

Huibo Zhao ¹

Ruofan Yu ¹

Sicong Ma ²

Kaizhuang Xu ¹

Yang Chen ¹

Kun Jiang ¹

Yuan Fang ¹

Caixia Zhu ¹

Xiaochen Liu ¹

Yu Tang ¹

Lizhi Wu ¹

Yingquan Wu ³

Qike Jiang ⁴

Peng He ^{3, 5}

Zhipan Liu ^{2, 6}

Li Tan ¹

Hide authors affiliations Show authors affiliations: 6 affiliations

Institute of Molecular Catalysis and In Situ/Operando Studies, State Key Laboratory of Photocatalysis on Energy and Environment, College of Chemistry, Fuzhou University, Fuzhou, China |

Key Laboratory of Synthetic and Self-Assembly Chemistry for Organic Functional Molecules, Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences, Shanghai, China |

State Key Laboratory of Coal Conversion, Institute of Coal Chemistry, Chinese Academy of Sciences, Taiyuan, China |

⁴

Dalian National Laboratory for Clean Energy, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian, China |

⁵

National Energy Research Center for Clean Fuels, Synfuels China Co., Ltd., Beijing, China |

⁶

Shanghai Key Laboratory of Molecular Catalysis and Innovative Materials, Key Laboratory of Computational Physical Science, Department of Chemistry, Fudan University, Shanghai, China |

Publication type: Journal Article

Publication date: 2022-09-15

Springer Nature

Journal: Nature Catalysis

Quartile SCImago

Quartile WOS

Impact factor: 37.8

ISSN: 25201158

DOI: 10.1038/s41929-022-00840-0

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Catalysis

Biochemistry

Process Chemistry and Technology

Bioengineering

Abstract

Copper-based catalysts for the hydrogenation of CO2 to methanol have attracted much interest. The complex nature of these catalysts, however, renders the elucidation of their structure–activity properties difficult. Here we report a copper-based catalyst with isolated active copper sites for the hydrogenation of CO2 to methanol. It is revealed that the single-atom Cu–Zr catalyst with Cu1–O3 units contributes solely to methanol synthesis around 180 °C, while the presence of small copper clusters or nanoparticles with Cu–Cu structural patterns are responsible for forming the CO by-product. Furthermore, the gradual migration of Cu1–O3 units with a quasiplanar structure to the catalyst surface is observed during the catalytic process and accelerates CO2 hydrogenation. The highly active, isolated copper sites and the distinguishable structural pattern identified here extend the horizon of single-atom catalysts for applications in thermal catalytic CO2 hydrogenation and could guide the further design of high-performance copper-based catalysts to meet industrial demand. Copper-based catalysts are traditionally very effective for the hydrogenation of CO2 to methanol, although control over the active site has remained elusive. Here, the authors design a Cu1/ZrO2 single-atom catalyst featuring a Cu1–O3 site responsible for a remarkable performance at 180 °C.

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Citations by journals

	2 4 6 8 10 12 14 16
ACS Catalysis	ACS Catalysis, 16, 6.96% ACS Catalysis 16 publications, 6.96%
Applied Catalysis B: Environmental	Applied Catalysis B: Environmental, 10, 4.35% Applied Catalysis B: Environmental 10 publications, 4.35%
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Journal of the American Chemical Society	Journal of the American Chemical Society, 7, 3.04% Journal of the American Chemical Society 7 publications, 3.04%
Journal of Catalysis	Journal of Catalysis, 7, 3.04% Journal of Catalysis 7 publications, 3.04%
Chemical Engineering Journal	Chemical Engineering Journal, 7, 3.04% Chemical Engineering Journal 7 publications, 3.04%
Nature Communications	Nature Communications, 7, 3.04% Nature Communications 7 publications, 3.04%
ChemCatChem	ChemCatChem, 7, 3.04% ChemCatChem 7 publications, 3.04%
Journal of Energy Chemistry	Journal of Energy Chemistry, 6, 2.61% Journal of Energy Chemistry 6 publications, 2.61%
Fuel	Fuel, 6, 2.61% Fuel 6 publications, 2.61%
Catalysis Today	Catalysis Today, 5, 2.17% Catalysis Today 5 publications, 2.17%
Catalysis Science and Technology	Catalysis Science and Technology, 5, 2.17% Catalysis Science and Technology 5 publications, 2.17%
Journal of Materials Chemistry A	Journal of Materials Chemistry A, 5, 2.17% Journal of Materials Chemistry A 5 publications, 2.17%
Advanced Materials	Advanced Materials, 5, 2.17% Advanced Materials 5 publications, 2.17%
Chinese Journal of Catalysis	Chinese Journal of Catalysis, 4, 1.74% Chinese Journal of Catalysis 4 publications, 1.74%
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Chemical Engineering Science	Chemical Engineering Science, 4, 1.74% Chemical Engineering Science 4 publications, 1.74%
Journal of Physical Chemistry C	Journal of Physical Chemistry C, 3, 1.3% Journal of Physical Chemistry C 3 publications, 1.3%
International Journal of Hydrogen Energy	International Journal of Hydrogen Energy, 3, 1.3% International Journal of Hydrogen Energy 3 publications, 1.3%
Molecular Catalysis	Molecular Catalysis, 3, 1.3% Molecular Catalysis 3 publications, 1.3%
EES Catalysis	EES Catalysis, 3, 1.3% EES Catalysis 3 publications, 1.3%
Resources Chemicals and Materials	Resources Chemicals and Materials, 3, 1.3% Resources Chemicals and Materials 3 publications, 1.3%
Industrial & Engineering Chemistry Research	Industrial & Engineering Chemistry Research, 3, 1.3% Industrial & Engineering Chemistry Research 3 publications, 1.3%
Journal of Physical Chemistry Letters	Journal of Physical Chemistry Letters, 3, 1.3% Journal of Physical Chemistry Letters 3 publications, 1.3%
Journal of Cleaner Production	Journal of Cleaner Production, 3, 1.3% Journal of Cleaner Production 3 publications, 1.3%
Applied Catalysis A: General	Applied Catalysis A: General, 3, 1.3% Applied Catalysis A: General 3 publications, 1.3%
ACS Nano	ACS Nano, 2, 0.87% ACS Nano 2 publications, 0.87%
New Journal of Chemistry	New Journal of Chemistry, 2, 0.87% New Journal of Chemistry 2 publications, 0.87%
Nano Letters	Nano Letters, 2, 0.87% Nano Letters 2 publications, 0.87%
	2 4 6 8 10 12 14 16

Citations by publishers

	10 20 30 40 50 60 70 80 90
Elsevier	Elsevier, 85, 36.96% Elsevier 85 publications, 36.96%
Wiley	Wiley, 48, 20.87% Wiley 48 publications, 20.87%
American Chemical Society (ACS)	American Chemical Society (ACS), 46, 20% American Chemical Society (ACS) 46 publications, 20%
Royal Society of Chemistry (RSC)	Royal Society of Chemistry (RSC), 26, 11.3% Royal Society of Chemistry (RSC) 26 publications, 11.3%
Springer Nature	Springer Nature, 12, 5.22% Springer Nature 12 publications, 5.22%
Multidisciplinary Digital Publishing Institute (MDPI)	Multidisciplinary Digital Publishing Institute (MDPI), 6, 2.61% Multidisciplinary Digital Publishing Institute (MDPI) 6 publications, 2.61%
OAE Publishing Inc.	OAE Publishing Inc., 2, 0.87% OAE Publishing Inc. 2 publications, 0.87%
Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii	Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii, 1, 0.43% Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii 1 publication, 0.43%
American Institute of Physics (AIP)	American Institute of Physics (AIP), 1, 0.43% American Institute of Physics (AIP) 1 publication, 0.43%
Oxford University Press	Oxford University Press, 1, 0.43% Oxford University Press 1 publication, 0.43%
Proceedings of the National Academy of Sciences (PNAS)	Proceedings of the National Academy of Sciences (PNAS), 1, 0.43% Proceedings of the National Academy of Sciences (PNAS) 1 publication, 0.43%
	10 20 30 40 50 60 70 80 90

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Zhao H. et al. The role of Cu1–O3 species in single-atom Cu/ZrO2 catalyst for CO2 hydrogenation // Nature Catalysis. 2022. Vol. 5. No. 9. pp. 818-831.

GOST all authors (up to 50) Copy

Zhao H., Yu R., Ma S., Xu K., Chen Y., Jiang K., Fang Y., Zhu C., Liu X., Tang Yu., Wu L., Wu Y., Jiang Q., He P., Liu Z., Tan L. The role of Cu1–O3 species in single-atom Cu/ZrO2 catalyst for CO2 hydrogenation // Nature Catalysis. 2022. Vol. 5. No. 9. pp. 818-831.

RIS |

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RIS Copy

TY - JOUR

DO - 10.1038/s41929-022-00840-0

UR - https://doi.org/10.1038/s41929-022-00840-0

TI - The role of Cu1–O3 species in single-atom Cu/ZrO2 catalyst for CO2 hydrogenation

T2 - Nature Catalysis

AU - Zhao, Huibo

AU - Yu, Ruofan

AU - Ma, Sicong

AU - Xu, Kaizhuang

AU - Chen, Yang

AU - Jiang, Kun

AU - Fang, Yuan

AU - Zhu, Caixia

AU - Liu, Xiaochen

AU - Tang, Yu

AU - Wu, Lizhi

AU - Wu, Yingquan

AU - Jiang, Qike

AU - He, Peng

AU - Liu, Zhipan

AU - Tan, Li

PY - 2022

DA - 2022/09/15 00:00:00

PB - Springer Nature

SP - 818-831

IS - 9

VL - 5

SN - 2520-1158

ER -

BibTex |

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BibTex Copy

@article{2022_Zhao,

author = {Huibo Zhao and Ruofan Yu and Sicong Ma and Kaizhuang Xu and Yang Chen and Kun Jiang and Yuan Fang and Caixia Zhu and Xiaochen Liu and Yu Tang and Lizhi Wu and Yingquan Wu and Qike Jiang and Peng He and Zhipan Liu and Li Tan},

title = {The role of Cu1–O3 species in single-atom Cu/ZrO2 catalyst for CO2 hydrogenation},

journal = {Nature Catalysis},

year = {2022},

volume = {5},

publisher = {Springer Nature},

month = {sep},

url = {https://doi.org/10.1038/s41929-022-00840-0},

number = {9},

pages = {818--831},

doi = {10.1038/s41929-022-00840-0}

}

MLA

Cite this

MLA Copy

Zhao, Huibo, et al. “The role of Cu1–O3 species in single-atom Cu/ZrO2 catalyst for CO2 hydrogenation.” Nature Catalysis, vol. 5, no. 9, Sep. 2022, pp. 818-831. https://doi.org/10.1038/s41929-022-00840-0.

Found error?

Publisher

Springer Nature

Journal

Nature Catalysis

Quartile SCImago

Quartile WOS

Impact factor

37.8

ISSN

25201158 (Electronic)