Constrained C
Journal
Nature
ISSN: 1476-4687
Titre abrégé: Nature
Pays: England
ID NLM: 0410462
Informations de publication
Date de publication:
May 2023
May 2023
Historique:
received:
25
01
2022
accepted:
02
03
2023
medline:
26
5
2023
pubmed:
4
5
2023
entrez:
3
5
2023
Statut:
ppublish
Résumé
The carbon dioxide and carbon monoxide electroreduction reactions, when powered using low-carbon electricity, offer pathways to the decarbonization of chemical manufacture
Identifiants
pubmed: 37138081
doi: 10.1038/s41586-023-05918-8
pii: 10.1038/s41586-023-05918-8
doi:
Types de publication
Journal Article
Langues
eng
Sous-ensembles de citation
IM
Pagination
724-729Informations de copyright
© 2023. The Author(s), under exclusive licence to Springer Nature Limited.
Références
Dinh, C. T. et al. CO
pubmed: 29773749
doi: 10.1126/science.aas9100
Li, C. W., Ciston, J. & Kanan, M. W. Electroreduction of carbon monoxide to liquid fuel on oxide-derived nanocrystalline copper. Nature 508, 504–507 (2014).
pubmed: 24717429
doi: 10.1038/nature13249
Zhong, M. et al. Accelerated discovery of CO
pubmed: 32405017
doi: 10.1038/s41586-020-2242-8
Lum, Y. & Ager, J. W. Evidence for product-specific active sites on oxide-derived Cu catalysts for electrochemical CO
doi: 10.1038/s41929-018-0201-7
Luc, W. et al. Two-dimensional copper nanosheets for electrochemical reduction of carbon monoxide to acetate. Nat. Catal. 2, 423–430 (2019).
doi: 10.1038/s41929-019-0269-8
Wang, X. et al. Efficient upgrading of CO to C
pubmed: 31780655
pmcid: 6882816
doi: 10.1038/s41467-019-13190-6
Jhong, H. R. M., Ma, S. & Kenis, P. J. Electrochemical conversion of CO
doi: 10.1016/j.coche.2013.03.005
Birdja, Y. Y. et al. Advances and challenges in understanding the electrocatalytic conversion of carbon dioxide to fuels. Nat. Energy 4, 732–745 (2019).
doi: 10.1038/s41560-019-0450-y
Nitopi, S. et al. Progress and perspectives of electrochemical CO
pubmed: 31117420
doi: 10.1021/acs.chemrev.8b00705
Jouny, M. et al. Formation of carbon–nitrogen bonds in carbon monoxide electrolysis. Nat. Chem. 11, 846–851 (2019).
pubmed: 31444485
doi: 10.1038/s41557-019-0312-z
Kibria, M. G. et al. Electrochemical CO
doi: 10.1002/adma.201807166
Fernández, L. Production Capacity of Acetic Acid Worldwide in 2018 and 2023 (Statista, 2021); https://www.statista.com/statistics/1063215/acetic-acid-production-capacity-globally/#statisticContainer .
Le Berre, C., Serp, P., Kalck, P. & Torrence, G. P. in Ullmann’s Encyclopedia of Industrial Chemistry (Ed. Ley, C.) 1−34 (Wiley-VCH, 2014).
Kiefer, D., Merkel, M., Lilge, L., Henkel, M. & Hausmann, R. From acetate to bio-based products: underexploited potential for industrial biotechnology. Trends Biotechnol. 39, 397–411 (2021).
pubmed: 33036784
doi: 10.1016/j.tibtech.2020.09.004
Bozzano, G. & Manenti, F. Efficient methanol synthesis: perspectives, technologies and optimization strategies. Prog. Energy Combust. Sci. 56, 71–105 (2016).
doi: 10.1016/j.pecs.2016.06.001
Dimian, A. C. & Kiss, A. A. Novel energy efficient process for acetic acid production by methanol carbonylation. Chem. Eng. Res. Des. 159, 1–12 (2020).
doi: 10.1016/j.cherd.2020.04.013
Kätelhön, A. et al. Methodology cm.chemicals. Version A (Carbon Minds, accessed 1 June 2021); www.carbon-minds.com/cm_chemicals_methodology_V1.00_2021.pdf .
Xia, C. et al. Continuous production of pure liquid fuel solutions via electrocatalytic CO
doi: 10.1038/s41560-019-0451-x
Ripatti, D. S., Veltman, T. R. & Kanan, M. W. Carbon monoxide gas diffusion electrolysis that produces concentrated C
doi: 10.1016/j.joule.2018.10.007
Zhu, P. et al. Direct and continuous generation of pure acetic acid solutions via electrocatalytic carbon monoxide reduction. Proc. Natl Acad. Sci. USA 118, e2010868118 (2021).
pubmed: 33380454
doi: 10.1073/pnas.2010868118
Zang, D. et al. Interface engineering of Mo
doi: 10.1016/j.apcatb.2020.119426
Li, Y. et al. A novel fuel electrode enabling direct CO
doi: 10.1039/C7TA05750D
Hauch, A. et al. Recent advances in solid oxide cell technology for electrolysis. Science 370, eaba6118 (2020).
pubmed: 33033189
doi: 10.1126/science.aba6118
Ozden, A. et al. Cascade CO
doi: 10.1016/j.joule.2021.01.007
Jouny, M., Hutchings, G. S. & Jiao, F. Carbon monoxide electroreduction as an emerging platform for carbon utilization. Nat. Catal. 2, 1062–1070 (2019).
doi: 10.1038/s41929-019-0388-2
Hori, Y., Murata, A. & Takahashi, R. Formation of hydrocarbons in the electrochemical reduction of carbon dioxide at a copper electrode in aqueous solution. J. Chem. Soc. Faraday Trans. 1 85, 2309–2326 (1989).
doi: 10.1039/f19898502309
Zhan, C. et al. Revealing the CO coverage-driven C-C coupling mechanism for electrochemical CO
pubmed: 34239771
pmcid: 8256421
doi: 10.1021/acscatal.1c01478
Deshpande, S., Maxson, T. & Greeley, J. Graph theory approach to determine configurations of multidentate and high coverage adsorbates for heterogeneous catalysis. npj Comput. Mater. 6, 79 (2020).
doi: 10.1038/s41524-020-0345-2
Kim, D., Resasco, J., Yu, Y., Asiri, A. M. & Yang, P. Synergistic geometric and electronic effects for electrochemical reduction of carbon dioxide using gold-copper bimetallic nanoparticles. Nat. Commun. 5, 4948 (2014).
pubmed: 25208828
doi: 10.1038/ncomms5948
Guo, H., Chen, Y., Ping, H., Wang, L. & Peng, D. L. One-pot synthesis of hexagonal and triangular nickel-copper alloy nanoplates and their magnetic and catalytic properties. J. Mater. Chem. 22, 8336–8344 (2012).
doi: 10.1039/c2jm16095a
Li, J. et al. Copper adparticle enabled selective electrosynthesis of n-propanol. Nat. Commun. 9, 4614 (2018).
pubmed: 30397203
pmcid: 6218481
doi: 10.1038/s41467-018-07032-0
Zhang, X. et al. Molecular engineering of dispersed nickel phthalocyanines on carbon nanotubes for selective CO
doi: 10.1038/s41560-020-0667-9
Karapinar, D. et al. Electroreduction of CO
doi: 10.1002/anie.201907994
Ma, M. et al. Local reaction environment for selective electroreduction of carbon monoxide. Energy Environ. Sci. 15, 2470–2478 (2022).
doi: 10.1039/D1EE03838A
Ma, S. et al. One-step electrosynthesis of ethylene and ethanol from CO
doi: 10.1016/j.jpowsour.2015.09.124
Ji, Y. et al. Selective CO-to-acetate electroreduction via intermediate adsorption tuning on ordered Cu–Pd sites. Nat. Catal. 5, 251–258 (2022).
doi: 10.1038/s41929-022-00757-8
Hjorth Larsen, A. et al. The atomic simulation environment - a Python library for working with atoms. J. Phys. Condens. Matter 29, 273002 (2017).
pubmed: 28323250
doi: 10.1088/1361-648X/aa680e
Montoya, J. H., Shi, C., Chan, K. & Nørskov, J. K. Theoretical insights into a CO dimerization mechanism in CO
pubmed: 26266498
doi: 10.1021/acs.jpclett.5b00722
Kresse, G. & Hafner, J. Ab initio molecular-dynamics simulation of the liquid-metalamorphous-semiconductor transition in germanium. Phys. Rev. B 49, 14251–14269 (1994).
doi: 10.1103/PhysRevB.49.14251
Kresse, G. & Furthmüller, J. Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set. Phys. Rev. B 54, 1169–11186 (1996).
doi: 10.1103/PhysRevB.54.11169
Kresse, G. & Furthmüller, J. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. Comput. Mater. Sci. 6, 15–50 (1996).
doi: 10.1016/0927-0256(96)00008-0
Kresse, G. & Hafner, J. Ab initio molecular dynamics for liquid metals. Phys. Rev. B 47, 558–561 (1993).
doi: 10.1103/PhysRevB.47.558
Perdew, J. P., Burke, K. & Ernzerhof, M. Generalized gradient approximation made simple. Phys. Rev. Lett. 77, 3865–3868 (1996).
pubmed: 10062328
doi: 10.1103/PhysRevLett.77.3865
Blöchl, P. E. Projector augmented-wave method. Phys. Rev. B 50, 17953–17979 (1994).
doi: 10.1103/PhysRevB.50.17953
Kresse, G. & Joubert, D. From ultrasoft pseudopotentials to the projector augmented-wave method. Phys. Rev. B 59, 1758–1775 (1999).
doi: 10.1103/PhysRevB.59.1758
Wang, X. et al. Gold-in-copper at low *CO coverage enables efficient electromethanation of CO
pubmed: 34099705
pmcid: 8184940
doi: 10.1038/s41467-021-23699-4
Wang, X. et al. Efficient methane electrosynthesis enabled by tuning local CO
pubmed: 31990189
doi: 10.1021/jacs.9b12445
Wang, X. et al. Efficient electrosynthesis of n-propanol from carbon monoxide using a Ag–Ru–Cu catalyst. Nat. Energy 7, 170–176 (2022).
doi: 10.1038/s41560-021-00967-7
Hohenberg, P. & Kohn, W. Inhomogeneous electron gas. Phys. Rev. 136, B864–B871 (1964).
doi: 10.1103/PhysRev.136.B864
Kohn, W. & Sham, L. J. Self-consistent equations including exchange and correlation effects. Phys. Rev. 140, A1133–A1138 (1965).
doi: 10.1103/PhysRev.140.A1133
Blaha, P., Schwarz, K., Sorantin, P. & Trickey, S. B. Full-potential, linearized augmented plane wave programs for crystalline systems. Comput. Phys. Commun. 59, 399–415 (1990).
doi: 10.1016/0010-4655(90)90187-6
Perdew, J. P. & Wang, Y. Accurate and simple analytic representation of the electron-gas correlation energy. Phys. Rev. B 45, 13244–13249 (1992).
doi: 10.1103/PhysRevB.45.13244
Rehr, J. J. & Albers, R. C. Theoretical approaches to x-ray absorption fine structure. Rev. Mod. Phys. 72, 621–654 (2000).
doi: 10.1103/RevModPhys.72.621
Ravel, B. & Newville, M. ATHENA, ARTEMIS, HEPHAESTUS: data analysis for X-ray absorption spectroscopy using IFEFFIT. J. Synchrotron Radiat. 12, 537–541 (2005).
pubmed: 15968136
doi: 10.1107/S0909049505012719
Freire, R. M. et al. Natural arrangement of AgCu bimetallic nanostructures through oleylamine reduction. Inorg. Chem. Front. 7, 4902–4912 (2020).
doi: 10.1039/D0QI00940G
Li, F. et al. Molecular tuning of CO
pubmed: 31747679
doi: 10.1038/s41586-019-1782-2
Zhang, B. et al. Manganese acting as a high-performance heterogeneous electrocatalyst in carbon dioxide reduction. Nat. Commun. 10, 2980 (2019).
pubmed: 31278257
pmcid: 6611886
doi: 10.1038/s41467-019-10854-1
Ogihara, H., Maezuru, T., Ogishima, Y. & Yamanaka, I. Electrocatalytic activity of Co-4,4′dimethyl-2,2′-bipyridine supported on Ketjenblack for reduction of CO
doi: 10.1007/s12678-017-0419-1