Publications

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2023

Hematite α-Fe2O3(0001) in Top and Side View: Resolving Long-Standing Controversies about Its Surface Structure

Redondo, Jesús; Michalička, Jan; Kraushofer, Florian; Franceschi, Giada; Šmid, Břetislav; Kumar, Nishant; Man, Ondřej; Blatnik, Matthias; Wrana, Dominik; Mallada, Benjamin; Švec, Martin; Parkinson, Gareth S.; Setvin, Martin; Riva, Michele; Diebold, Ulrike; Čechal, Jan

Hematite α-Fe2O3(0001) in Top and Side View: Resolving Long-Standing Controversies about Its Surface Structure

Journal ArticleOpen Access

In: Advanced Materials Interfaces, no. 2300602, 2023.

Abstract | Links | BibTeX | Tags: P02, P04

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

Kraushofer, Florian; Meier, Matthias; Jakub, Zdeněk; Hütner, Johanna; Balajka, Jan; Hulva, Jan; Schmid, Michael; Franchini, Cesare; Diebold, Ulrike; Parkinson, Gareth S.

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

Journal ArticleOpen Access

In: vol. 14, no. 13, pp. 3258–3265, 2023.

Abstract | Links | BibTeX | Tags: P02, P04, P07

2022

Surface chemistry on a polarizable surface: Coupling of CO with KTaO 3(001)

Wang, Zhichang; Reticcioli, Michele; Jakub, Zdenek; Sokolović, Igor; Meier, Matthias; Boatner, Lynn A; Schmid, Michael; Parkinson, Gareth S.; Diebold, Ulrike; Franchini, Cesare; Setvin, Martin

Surface chemistry on a polarizable surface: Coupling of CO with KTaO 3(001)

Journal ArticleOpen Access

In: Science Advances, vol. 8, iss. 33, 2022.

Abstract | Links | BibTeX | Tags: P02, P04, P07

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

Sombut, Panukorn; Puntscher, Lena; Atzmüller, Marlene; Jakub, Zdenek; Reticcioli, Michele; Meier, Matthias; Parkinson, Gareth S.; Franchini, Cesare

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

Journal ArticleOpen Access

In: Topics in Catalysis, vol. 65, pp. 1620–1630, 2022.

Abstract | Links | BibTeX | Tags: P04, P07

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

Meier, Matthias; Hulva, Jan; Jakub, Zdenek; Kraushofer, Florian; Bobić, Mislav; Bliem, Roland; Setvin, Martin; Schmid, Michael; Diebold, Ulrike; Franchini, Cesare; Parkinson, Gareth S.

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

Journal ArticleOpen Access

In: ScienceAdvances, vol. 8, iss. 13, pp. eabn4580, 2022.

Abstract | Links | BibTeX | Tags: P02, P04, P07

2021

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

Mirabella, Francesca; Müllner, Matthias; Touzalin, Thomas; Riva, Michele; Jakub, Zdenek; Kraushofer, Florian; Schmid, Michael; Koper, Marc T M; Parkinson, Gareth S.; Diebold, Ulrike

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

Journal ArticleOpen Access

In: Electrochimica Acta, vol. 389, pp. 138638, 2021.

Abstract | Links | BibTeX | Tags: P02, P04, pre-TACO

Unraveling CO adsorption on model single-atom catalysts

Hulva, Jan; Meier, Matthias; Bliem, Roland; Jakub, Zdenek; Kraushofer, Florian; Schmid, Michael; Diebold, Ulrike; Franchini, Cesare; Parkinson, Gareth S.

Unraveling CO adsorption on model single-atom catalysts

Journal Article

In: Science, vol. 371, no. 6527, pp. 375–379, 2021.

Abstract | Links | BibTeX | Tags: P02, P04, P07, pre-TACO

2020

IrO2 Surface Complexions Identified through Machine Learning and Surface Investigations

Timmermann, Jakob; Kraushofer, Florian; Resch, Nikolaus; Li, Peigang; Wang, Yu; Mao, Zhiqiang; Riva, Michele; Lee, Yonghyuk; Staacke, Carsten; Schmid, Michael; Scheurer, Christoph; Parkinson, Gareth S.; Diebold, Ulrike; Reuter, Karsten

IrO2 Surface Complexions Identified through Machine Learning and Surface Investigations

Journal Article

In: Physical Review Letters, vol. 125, no. 20, pp. 206101, 2020.

Abstract | Links | BibTeX | Tags: P02, P04, pre-TACO

Electrochemical Stability of the Reconstructed Fe3O4(001) Surface

Grumelli, Doris; Wiegmann, Tim; Barja, Sara; Reikowski, Finn; Maroun, Fouad; Allongue, Philippe; Balajka, Jan; Parkinson, Gareth S.; Diebold, Ulrike; Kern, Klaus; Magnussen, Olaf M

Electrochemical Stability of the Reconstructed Fe3O4(001) Surface

Journal Article

In: Angewandte Chemie - International Edition, vol. 59, no. 49, pp. 21904–21908, 2020.

Abstract | Links | BibTeX | Tags: P02, P04, pre-TACO

2019

Local Structure and Coordination Define Adsorption in a Model Ir1/Fe3O4 Single-Atom Catalyst

Jakub, Zdenek; Hulva, Jan; Meier, Matthias; Bliem, Roland; Kraushofer, Florian; Setvin, Martin; Schmid, Michael; Diebold, Ulrike; Franchini, Cesare; Parkinson, Gareth S.

Local Structure and Coordination Define Adsorption in a Model Ir1/Fe3O4 Single-Atom Catalyst

Journal ArticleOpen Access

In: Angewandte Chemie - International Edition, vol. 58, no. 39, pp. 13961–13968, 2019.

Abstract | Links | BibTeX | Tags: P02, P04, P07, pre-TACO