Evolving Single-Atom Catalysis: Fundamental Insights for Rational Design

Project Information

E-SAC

Grant agreement ID: 864628

DOI

10.3030/864628

EC signature date 28 January 2020

Start date 1 February 2020

End date 31 January 2026

Funded under

• EXCELLENT SCIENCE - European Research Council (ERC)

Total cost

€ 1 993 718,00

EU contribution

€ 1 993 718,00

Coordinated by

TECHNISCHE UNIVERSITAET WIEN
Austria

CORDIS provides links to public deliverables and publications of HORIZON projects.

Links to deliverables and publications from FP7 projects, as well as links to some specific result types such as dataset and software, are dynamically retrieved from OpenAIRE .

Publications

Peer reviewed articles (21)

IrO 2 Surface Complexions Identified through Machine Learning and Surface Investigations

Author(s): Jakob Timmermann, Florian Kraushofer, Nikolaus Resch, Peigang Li, Yu Wang, Zhiqiang Mao, Michele Riva, Yonghyuk Lee, Carsten Staacke, Michael Schmid, Christoph Scheurer, Gareth S. Parkinson, Ulrike Diebold, Karsten Reuter
Published in: Physical Review Letters, Issue 125/20, 2020, ISSN 0031-9007
Publisher: American Physical Society
DOI: 10.1103/physrevlett.125.206101

Digging Its Own Site: Linear Coordination Stabilizes a Pt₁/Fe₂O₃ Single-Atom Catalyst

Author(s): Ali Rafsanjani-Abbasi, Florian Buchner, Faith J. Lewis, Lena Puntscher, Florian Kraushofer, Panukorn Sombut, Moritz Eder, Jiří Pavelec, Erik Rheinfrank, Giada Franceschi, Viktor Birschitzky, Michele Riva, Cesare Franchini, Michael Schmid, Ulrike Diebold, Matthias Meier, Georg K. H. Madsen, Gareth S. Parkinson
Published in: ACS Nano, 2024, ISSN 1936-0851
Publisher: American Chemical Society
DOI: 10.1021/acsnano.4c08781

Formation and stability of Fe-rich terminations of the Fe₃O₄(001) surface

Author(s): Oscar Gamba, Moritz Eder, Matthias Poglitsch, Jiri Pavelec, Panukorn Sombut, Matthias Meier, Ulrike Diebold, Michael Schmid, Gareth S Parkinson
Published in: Materials Research Express, Issue 10, 2023, Page(s) 116517, ISSN 2053-1591
Publisher: IOP
DOI: 10.1088/2053-1591/ad0ac5

Surface Reduction State Determines Stabilization and Incorporation of Rh on α‐Fe 2 O 3 (11¯02)

Author(s): Florian Kraushofer, Nikolaus Resch, Moritz Eder, Ali Rafsanjani‐Abbasi, Sarah Tobisch, Zdenek Jakub, Giada Franceschi, Michele Riva, Matthias Meier, Michael Schmid, Ulrike Diebold, Gareth S. Parkinson
Published in: Advanced Materials Interfaces, Issue 8/8, 2021, Page(s) 2001908, ISSN 2196-7350
Publisher: Wiley
DOI: 10.1002/admi.202001908

A Multitechnique Study of C₂H₄ Adsorption on Fe₃O₄(001)

Author(s): Lena Puntscher, Panukorn Sombut, Chunlei Wang, Manuel Ulreich, Jiri Pavelec, Ali Rafsanjani-Abbasi, Matthias Meier, Adam Lagin, Martin Setvin, Ulrike Diebold, Cesare Franchini, Michael Schmid, Gareth S. Parkinson
Published in: The Journal of Physical Chemistry C, Issue 127, 2023, Page(s) 18378-18388, ISSN 1932-7447
Publisher: American Chemical Society
DOI: 10.1021/acs.jpcc.3c03684

Oxygen-Terminated (1 × 1) Reconstruction of Reduced Magnetite Fe₃O₄(111)

Author(s): Florian Kraushofer, Matthias Meier, Zdeněk Jakub, Johanna Hütner, Jan Balajka, Jan Hulva, Michael Schmid, Cesare Franchini, Ulrike Diebold, Gareth S. Parkinson
Published in: The Journal of Physical Chemistry Letters, Issue 14, 2023, Page(s) 3258-3265, ISSN 1948-7185
Publisher: American Chemical Society
DOI: 10.1021/acs.jpclett.3c00281

Single Rh Adatoms Stabilized on α-Fe2O3(11̅02) by Coadsorbed Water

Author(s): Florian Kraushofer, Lena Haager, Moritz Eder, Ali Rafsanjani-Abbasi, Zdeněk Jakub, Giada Franceschi, Michele Riva, Matthias Meier, Michael Schmid, Ulrike Diebold, and Gareth S. Parkinson
Published in: ACS Energy Letters, Issue 7, 2022, Page(s) 375-380, ISSN 2380-8195
Publisher: American Chemical Society
DOI: 10.1021/acsenergylett.1c02405

Electrochemical Stability of the Reconstructed Fe 3 O 4 (001) Surface

Author(s): Doris Grumelli, Tim Wiegmann, Sara Barja, Finn Reikowski, Fouad Maroun, Philippe Allongue, Jan Balajka, Gareth S. Parkinson, Ulrike Diebold, Klaus Kern, Olaf M. Magnussen
Published in: Angewandte Chemie, Issue 132/49, 2020, Page(s) 22088-22092, ISSN 0044-8249
Publisher: John Wiley & Sons Ltd.
DOI: 10.1002/ange.202008785

Role of Polarons in Single-Atom Catalysts: Case Study of Me1 [Au1, Pt1, and Rh1] on TiO2(110)

Author(s): Panukorn Sombut; Lena Puntscher; Marlene Atzmueller; Zdenek Jakub; Michele Reticcioli; Matthias Meier; Gareth S. Parkinson; Cesare Franchini
Published in: Topics in Catalysis, 2022, ISSN 1022-5528
Publisher: Baltzer Science Publishers B.V.
DOI: 10.1007/s11244-022-01651-0

Infrared reflection absorption spectroscopy setup with incidence angle selection for surfaces of non-metals

Author(s): David Rath, Vojtěch Mikerásek, Chunlei Wang, Moritz Eder, Michael Schmid, Ulrike Diebold, Gareth S. Parkinson, Jiří Pavelec
Published in: Review of Scientific Instruments, Issue 95, 2024, ISSN 0034-6748
Publisher: American Institute of Physics
DOI: 10.1063/5.0210860

CO‐Induced Dimer Decay Responsible for Gem‐Dicarbonyl Formation on a Model Single‐Atom Catalyst

Author(s): Chunlei Wang, Panukorn Sombut, Lena Puntscher, Zdenek Jakub, Matthias Meier, Jiri Pavelec, Roland Bliem, Michael Schmid, Ulrike Diebold, Cesare Franchini, Gareth S. Parkinson
Published in: Angewandte Chemie International Edition, Issue 63, 2024, ISSN 1433-7851
Publisher: John Wiley & Sons Ltd.
DOI: 10.1002/anie.202317347

Atomic‐Scale Studies of Fe 3 O 4 (001) and TiO 2 (110) Surfaces Following Immersion in CO 2 ‐Acidified Water

Author(s): Francesca Mirabella, Jan Balajka, Jiri Pavelec, Markus Göbel, Florian Kraushofer, Michael Schmid, Gareth S. Parkinson, Ulrike Diebold
Published in: ChemPhysChem, Issue 21/16, 2020, Page(s) 1788-1796, ISSN 1439-4235
Publisher: John Wiley & Sons Ltd.
DOI: 10.1002/cphc.202000471

Unraveling CO adsorption on model single-atom catalysts

Author(s): Jan Hulva, Matthias Meier, Roland Bliem, Zdenek Jakub, Florian Kraushofer, Michael Schmid, Ulrike Diebold, Cesare Franchini, Gareth S. Parkinson
Published in: Science, Issue 371/6527, 2021, Page(s) 375-379, ISSN 0036-8075
Publisher: American Association for the Advancement of Science
DOI: 10.1126/science.abe5757

CO oxidation by Pt2/Fe3O4: Metastable dimer and support configurations facilitate lattice oxygen extraction

Author(s): Matthias Meier, Jan Hulva, Zdenek Jakub, Florian Kraushofer, Mislav Bobić, Roland Bliem, Martin Setvin, Michael Schmid, Ulrike Diebold, Cesare Franchini, Gareth S Parkinson
Published in: Science Advances, Issue 8, 2022, Page(s) eabn4580, ISSN 2375-2548
Publisher: AAAS
DOI: 10.1126/sciadv.abn4580

Single-Atom Catalysis: Insights from Model Systems

Author(s): Florian Kraushofer, Gareth S. Parkinson
Published in: Chemical Reviews, 2022, ISSN 0009-2665
Publisher: American Chemical Society
DOI: 10.1021/acs.chemrev.2c00259

Stability of Iridium Single Atoms on Fe₃O₄(001) in the mbar Pressure Range

Author(s): Nicolo Comini, J. Trey Diulus, Gareth S. Parkinson, Jürg Osterwalder, Zbynek Novotny
Published in: The Journal of Physical Chemistry C, Issue 127, 2023, Page(s) 19097-19106, ISSN 1932-7447
Publisher: American Chemical Society
DOI: 10.1021/acs.jpcc.3c03097

A Multitechnique Study of C₂H₄ Adsorption on a Model Single-Atom Rh₁ Catalyst

Author(s): Chunlei Wang, Panukorn Sombut, Lena Puntscher, Manuel Ulreich, Jiri Pavelec, David Rath, Jan Balajka, Matthias Meier, Michael Schmid, Ulrike Diebold, Cesare Franchini, Gareth S. Parkinson
Published in: The Journal of Physical Chemistry C, Issue 128, 2024, Page(s) 15404-15411, ISSN 1932-7447
Publisher: American Chemical Society
DOI: 10.1021/acs.jpcc.4c03588

Ni-modified Fe3O4(001) surface as a simple model system for understanding the oxygen evolution reaction

Author(s): Francesca Mirabella, Matthias Müllner, Thomas Touzalin, Michele Riva, Zdenek Jakub, Florian Kraushofer, Michael Schmid, Marc T.M. Koper, Gareth S. Parkinson, Ulrike Diebold
Published in: Electrochimica Acta, Issue 389, 2021, Page(s) 138638, ISSN 0013-4686
Publisher: Pergamon Press Ltd.
DOI: 10.1016/j.electacta.2021.138638

A study of Pt, Rh, Ni and Ir dispersion on anatase TiO2(101) and the role of water

Author(s): Lena Puntscher, Kevin Daninger, Michael Schmid, Ulrike Diebold, Gareth S. Parkinson
Published in: Electrochimica Acta, Issue 449, 2024, Page(s) 142190, ISSN 0013-4686
Publisher: Pergamon Press Ltd.
DOI: 10.1016/j.electacta.2023.142190

Hematite <i>α</i>‐Fe₂O₃(0001) in Top and Side View: Resolving Long‐Standing Controversies about Its Surface Structure

Author(s): Jesús Redondo, Jan Michalička, Florian Kraushofer, Giada Franceschi, Břetislav Šmid, Nishant Kumar, Ondřej Man, Matthias Blatnik, Dominik Wrana, Benjamin Mallada, Martin Švec, Gareth S. Parkinson, Martin Setvin, Michele Riva, Ulrike Diebold, Jan Čechal
Published in: Advanced Materials Interfaces, Issue 10, 2023, Page(s) 2300602, ISSN 2196-7350
Publisher: Wiley
DOI: 10.1002/admi.202300602

Rapid oxygen exchange between hematite and water vapor

Author(s): Zdenek Jakub, Matthias Meier, Florian Kraushofer, Jan Balajka, Jiri Pavelec, Michael Schmid, Cesare Franchini, Ulrike Diebold, Gareth S Parkinson
Published in: Nature Commuications, Issue 12, 2021, Page(s) 6488, ISSN 2041-1723
Publisher: Nature Publishing Group
DOI: 10.1038/s41467-021-26601-4