Jan Rossmeisl

Jan Rossmeisl

Professor

ORCID: 0000-0001-7749-6567

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  1. Published

    Orientation-Dependent Oxygen Evolution on RuO2 without Lattice Exchange

    Stoerzinger, K. A., Diaz-Morales, O., Kolb, M., Rao, R. R., Frydendal, R., Qiao, L., Wang, X. R., Halck, N. B., Rossmeisl, Jan, Hansen, H. A., Vegge, T., Stephens, I. E. L., Koper, M. T. M. & Shao-Horn, Y., 2017, In: ACS Energy Letters. 2, 4, p. 876-881 5 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  2. Published

    Structure of the (Bi)carbonate Adlayer on Cu(100) Electrodes

    Amirbeigiarab, R., Bagger, A., Tian, J., Rossmeisl, Jan & Magnussen, O. M., 2022, In: Angewandte Chemie International Edition. 61, 46, 7 p., e202211360.

    Research output: Contribution to journal › Letter › Research › peer-review

  3. Published

    Fundamental limitation of electrocatalytic methane conversion to methanol

    Arnarson, L., Schmidt, P. S., Pandey, M., Bagger, A., Thygesen, K. S., Stephens, I. E. L. & Rossmeisl, Jan, 2018, In: Physical Chemistry Chemical Physics. 20, 16, p. 11152-11159 8 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  4. Published

    Ru rich Ru-Mn-O phases for selective suppression of chlorine evolution in sea water electrolysis

    Astudillo, C., Macounová, K. M., Frandsen, Adrian Malthe, Nebel, R., Rossmeisl, Jan & Krtil, P., 2023, In: Electrochimica Acta. 470, 11 p., 143295.

    Research output: Contribution to journal › Journal article › Research › peer-review

  5. Published

    Electrochemical CO2 Reduction: Classifying Cu Facets

    Bagger, A., Ju, W., Sofia Varela, A., Strasser, P. & Rossmeisl, Jan, Sep 2019, In: ACS Catalysis. 9, 9, p. 7894-7899

    Research output: Contribution to journal › Journal article › Research › peer-review

  6. Published

    Single site porphyrine-like structures advantages over metals for selective electrochemical CO2 reduction

    Bagger, A., Ju, W., Varela, A. S., Strasser, P. & Rossmeisl, Jan, 2017, In: Catalysis Today. 288, p. 74-78 5 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  7. Published

    Catalytic CO2/CO Reduction: Gas, Aqueous, and Aprotic Phases

    Bagger, A., Christensen, Oliver, Ivanistsev, Vladislav & Rossmeisl, Jan, 18 Feb 2022, In: ACS Catalysis. 12, 4, p. 2561-2568 8 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  8. Published

    Correlations between experiments and simulations for formic acid oxidation

    Bagger, A., Jensen, K. D., Rashedi, M., Du, J., Luo, R., Zhang, D., Pereira, I. J., Escudero Escribano, Maria, Arenz, Matthias & Rossmeisl, Jan, 2022, In: Chemical Science. 13, 45, p. 13409-13417 9 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  9. Published

    Electrochemical CO Reduction: A Property of the Electrochemical Interface

    Bagger, A., Arnarson, L., Hansen, M. H., Spohr, E. & Rossmeisl, Jan, 30 Jan 2019, In: Journal of the American Chemical Society. 141, 4, p. 1506-1514

    Research output: Contribution to journal › Journal article › Research › peer-review

  10. Published

    Role of Catalyst in Controlling N2 Reduction Selectivity: A Unified View of Nitrogenase and Solid Electrodes

    Bagger, A., Wan, H., Stephens, I. E. L. & Rossmeisl, Jan, 2021, In: ACS Catalysis. 11, 11, p. 6596-6601 6 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  11. Published

    Electrochemical CO2 Reduction: A Classification Problem

    Bagger, A., Ju, W., Sofia Varela, A., Strasser, P. & Rossmeisl, Jan, 2017, In: ChemPhysChem. 18, 22, p. 3266-3273 8 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  12. Published

    Ab Initio Cyclic Voltammetry on Cu(111), Cu(100) and Cu(110) in Acidic, Neutral and Alkaline Solutions

    Bagger, A., Arán-Ais, R. M., Halldin Stenlid, J., Campos Dos Santos, E., Arnarson, L., Jensen, K. D., Escudero Escribano, Maria, Roldan Cuanya, B. & Rossmeisl, Jan, 2019, In: ChemPhysChem. 20, 22, p. 3096-3105

    Research output: Contribution to journal › Journal article › Research › peer-review

  13. Published

    Unravelling Composition–Activity–Stability Trends in High Entropy Alloy Electrocatalysts by Using a Data‐Guided Combinatorial Synthesis Strategy and Computational Modeling

    Banko, L., Krysiak, O. A., Pedersen, Jack Kirk, Xiao, B., Savan, A., Löffler, T., Baha, S., Rossmeisl, Jan, Schuhmann, W. & Ludwig, A., 2022, In: Advanced Energy Materials. 12, 8, 9 p., 2103312.

    Research output: Contribution to journal › Journal article › Research › peer-review

  14. Published

    Complex‐Solid‐Solution Electrocatalyst Discovery by Computational Prediction and High‐Throughput Experimentation**

    Batchelor, T. A. A., Löffler, T., Xiao, B., Krysiak, O. A., Strotkötter, V., Pedersen, Jack Kirk, Clausen, C. M., Savan, A., Li, Y., Schuhmann, W., Rossmeisl, Jan & Ludwig, A., 22 Mar 2021, In: Angewandte Chemie International Edition. 60, 13, p. 6932-6937 6 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  15. Published

    High-Entropy Alloys as a Discovery Platform for Electrocatalysis

    Batchelor, T. A. A., Pedersen, Jack Kirk, Winther, S. H., Castelli, I. E., Jacobsen, K. W. & Rossmeisl, Jan, 2019, In: Joule. 3, 3, p. 834-845

    Research output: Contribution to journal › Journal article › Research › peer-review

  16. Published

    Understanding Cation Effects on the Hydrogen Evolution Reaction

    Bender, J. T., Petersen, Amanda Schramm, ostergaard, F. C., Wood, M. A., Heffernan, S. M. J., Milliron, D. J., Rossmeisl, Jan & Resasco, J., 2023, In: ACS Energy Letters. 8, 1, p. 657–665 9 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  17. Published

    CO2 electroreduction on copper-cobalt nanoparticles: Size and composition effect

    Bernal, M., Bagger, A., Scholten, F., Sinev, I., Bergmann, A., Ahmadi, M., Rossmeisl, Jan & Cuenya, B. R., 2018, In: Nano Energy. 53, p. 27-36 10 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  18. Published

    Defect Chemistry and Electrical Conductivity of Sm-Doped La1–xSrxCoO3−δ for Solid Oxide Fuel Cells

    Bjorketun, M. E., Castelli, I. E., Rossmeisl, Jan, Olsen, T., Ukai, K., Kato, M., Dennler, G. & Jacobsen, K. W., 2017, In: The Journal of Physical Chemistry Part C. 121, 28, p. 15017-15027 11 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  19. Published

    Water at interfaces

    Björneholm, O., Hansen, M. H., Hodgson, A., Liu, L., Limmer, D. T., Michaelides, A., Pedevilla, P., Rossmeisl, Jan, Shen, H., Tocci, G., Tyrode, E., Walz, M., Werner, J. & Bluhm, H., 2016, In: Chemical Reviews. 116, 13, p. 7698-7726 29 p.

    Research output: Contribution to journal › Review › Research › peer-review

  20. Published

    Beyond the top of the volcano? – A unified approach to electrocatalytic oxygen reduction and oxygen evolution

    Busch, M., Halck, N. B., Kramm, U. I., Siahrostami, S., Krtil, P. & Rossmeisl, Jan, 2016, In: Nano Energy. 29, p. 126-135 10 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  21. Published

    The Influence of Inert Ions on the Reactivity of Manganese Oxides

    Busch, M., Wang, R. B., Hellman, A., Rossmeisl, Jan & Grönbeck, H., 2018, In: The Journal of Physical Chemistry Part C. 122, 1, p. 216-226 11 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  22. Published

    The role of an interface in stabilizing reaction intermediates for hydrogen evolution in aprotic electrolytes

    Castelli, I. E., Zorko, M., Østergaard, T. M., Martins, P. F. B. D., Lopes, P. P., Antonopoulos, B. K., Maglia, F., Markovic, N. M., Strmcnik, D. & Rossmeisl, Jan, 2020, In: Chemical Science. 11, 15, p. 3914-3922

    Research output: Contribution to journal › Journal article › Research › peer-review

  23. Published

    Role of the Band Gap for the Interaction Energy of Coadsorbed Fragments

    Castelli, I. E., Man, I., Soriga, S., Parvulescu, V., Halck, N. B. & Rossmeisl, Jan, 2017, In: The Journal of Physical Chemistry Part C. 121, 34, p. 18608-18614 7 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  24. Published

    Surface Curvature Effect on Dual-Atom Site Oxygen Electrocatalysis

    Cepitis, R., Kongi, N., Rossmeisl, Jan & Ivanistsev, Vladislav, 2023, In: ACS Energy Letters. 8, 3, p. 1330-1335 6 p.

    Research output: Contribution to journal › Letter › Research › peer-review

  25. Published

    Bypassing the scaling relations in oxygen electrocatalysis with geometry-adaptive catalysts

    Cepitis, R., Ivaništšev, V., Rossmeisl, Jan & Kongi, N., 2024, In: Catalysis Science and Technology. 14, 8, p. 2105–2113 9 p.

    Research output: Contribution to journal › Letter › Research › peer-review

  26. Published

    Can the CO2 Reduction Reaction Be Improved on Cu: Selectivity and Intrinsic Activity of Functionalized Cu Surfaces

    Christensen, Oliver, Zhao, S., Sun, Z., Bagger, A., Lauritsen, J. V., Pedersen, S. U., Daasbjerg, K. & Rossmeisl, Jan, 2022, In: ACS Catalysis. 12, 24, p. 15737-15749 13 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  27. Published

    The Missing Link for Electrochemical CO2 Reduction: Classification of CO vs HCOOH Selectivity via PCA, Reaction Pathways, and Coverage Analysis

    Christensen, Oliver, Bagger, A. & Rossmeisl, Jan, 2024, In: ACS Catalysis. 14, 4, p. 2151-2161 11 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  28. Published

    Tuning the chemical composition of binary alloy nanoparticles to prevent their dissolution

    Cipriano, L. A., Kristoffersen, Henrik Høgh, Munhos, R. L., Pittkowski, Rebecca Katharina, Arenz, Matthias & Rossmeisl, Jan, 2023, In: Nanoscale. 15, 41, p. 16697–16705 9 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  29. Published

    Ab Initio to Activity: Machine Learning-Assisted Optimization of High-Entropy Alloy Catalytic Activity

    Clausen, Christian Møgelberg, Nielsen, Martin Lillebro Striib, Pedersen, Jack Kirk & Rossmeisl, Jan, 2023, In: High Entropy Alloys & Materials. 1, p. 120–133 14 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  30. Published

    Lattice distortion releasing local surface strain on high-entropy alloys

    Clausen, C. M., Pedersen, Jack Kirk, Batchelor, T. A. A. & Rossmeisl, Jan, 2022, In: Nano Research. 15, p. 4775–4779

    Research output: Contribution to journal › Journal article › Research › peer-review

  31. Published

    A Flexible Theory for Catalysis: Learning Alkaline Oxygen Reduction on Complex Solid Solutions within the Ag−Pd−Pt−Ru Composition Space**

    Clausen, C. M., Krysiak, O. A., Banko, L., Pedersen, Jack Kirk, Schuhmann, W., Ludwig, A. & Rossmeisl, Jan, 2023, In: Angewandte Chemie - International Edition. 62, 39, 8 p., e202307187.

    Research output: Contribution to journal › Journal article › Research › peer-review

  32. Published

    What Atomic Positions Determines Reactivity of a Surface? Long‐Range, Directional Ligand Effects in Metallic Alloys

    Clausen, C. M., Batchelor, T. A. A., Pedersen, Jack Kirk & Rossmeisl, Jan, 2021, In: Advanced Science. 8, 9, 7 p., 2003357.

    Research output: Contribution to journal › Journal article › Communication

  33. Published

    Tailoring the facet distribution on copper with chloride

    Couce, P. M., Madsen, Thor Kongstad, Plaza Mayoral, Elena, Kristoffersen, Henrik Høgh, Chorkendorff, I., Dalby, K. N., van der Stam, W., Rossmeisl, Jan, Escudero Escribano, Maria & Sebastian Pascual, Paula, 2024, In: Chemical Science. 15, 5, p. 1714–1725 12 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  34. Published

    Topotactic growth of edge-terminated MoS2 from MoO2 nanocrystal surfaces

    Dahl-Petersen, C., Šarić, M., Brorson, M., Moses, P. G., Rossmeisl, Jan, Lauritsen, J. & Helveg, S., 2018, In: A C S Nano. 12, 6, p. 5351-5358 8 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  35. Published

    Electrochemically Generated Copper Carbonyl for Selective Dimethyl Carbonate Synthesis

    Davies, B., Saric, M., Figueiredo, M., Schjødt, N., Dahl, S., Moses, P., Escudero Escribano, Maria, Arenz, Matthias & Rossmeisl, Jan, 2019, In: ACS Catalysis. 9, 2, p. 859-866 8 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  36. Published

    Electrochemical Synthesis of High-Value Chemicals: Detection of Key Reaction Intermediates and Products Combining Gas Chromatography-Mass Spectrometry and in Situ Infrared Spectroscopy

    Davies, B. J. V., Arenz, Matthias, Rossmeisl, Jan & Escudero Escribano, Maria, 23 May 2019, In: Journal of Physical Chemistry C. 123, 20, p. 12762-12772

    Research output: Contribution to journal › Journal article › Research › peer-review

  37. Published

    Oxygen reduction reaction on Pt overlayers deposited onto a gold film: ligand, strain, and ensemble effect

    Deng, Y., Tripkovic, V., Rossmeisl, Jan & Arenz, Matthias, 2016, In: ACS Catalysis. 6, 2, p. 671-676 6 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  38. Published

    Lifting the discrepancy between experimental results and the theoretical predictions for the catalytic activity of RuO2(110) towards oxygen evolution reaction

    Divanis, S., Frandsen, A. M., Kutlusoy, T. & Rossmeisl, Jan, 2021, In: Physical Chemistry Chemical Physics. 23, 35, p. 19141-19145 5 p.

    Research output: Contribution to journal › Letter › Research › peer-review

  39. Published

    Oxygen evolution reaction: a perspective on a decade of atomic scale simulations

    Divanis, S., Kutlusoy, T., Ingmer Boye, I. M., Man, I. C. & Rossmeisl, Jan, 2020, In: Chemical Science. 11, 11, p. 2943-2950

    Research output: Contribution to journal › Journal article › Research › peer-review

  40. Published

    Tuning the activity of Pt alloy electrocatalysts by means of the lanthanide contraction

    Escudero Escribano, Maria, Malacrida, P., Hansen, M. H., Vej-Hansen, U. G., Velazquez-Palenzuela, A. A., Tripkovic, V., Schiøtz, J., Rossmeisl, Jan, Stephens, I. & Chorkendorff, I., 2016, In: Science. 352, 6281, p. 73-76 4 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  41. Published

    Importance of Surface IrOx in Stabilizing RuO2 for Oxygen Evolution

    Escudero Escribano, Maria, Pedersen, A. F., Paoli, E. A., Frydendal, R., Friebel, D., Malacrida, P., Rossmeisl, Jan, Stephens, I. E. L. & Chorkendorff, I., 2018, In: Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces & Biophysical. 122, 2, p. 947-955 9 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  42. Published

    Pt5Gd as a Highly Active and Stable Catalyst for Oxygen Electroreduction

    Escudero Escribano, Maria, Verdaguer-Casadevall, A., Malacrida, P., Gronbjerg, U., Knudsen, B. P., Jepsen, A. K., Rossmeisl, Jan, Stephens, I. E. L. & Chorkendorff, I., 2012, In: Journal of the American Chemical Society. 134, 40, p. 16476-16479 4 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  43. Published

    Frontispiece: Active-Phase Formation and Stability of Gd/Pt(111) Electrocatalysts for Oxygen Reduction: An In Situ Grazing Incidence X-Ray Diffraction Study

    Escudero Escribano, Maria, Pedersen, A. F., Ulrikkeholm, E. T., Jensen, K. D., Hansen, M. H., Rossmeisl, Jan, Stephens, I. E. L. & Chorkendorff, I., 2018, In: Chemistry - A European Journal. 24, 47

    Research output: Contribution to journal › Journal article › Research › peer-review

  44. Published

    Toward an active and stable catalyst for oxygen evolution in acidic media: Ti-stabilized MnO2

    Frydendal, R., Paoli, E. A., Chorkendorff, I., Rossmeisl, Jan & Stephens, I. E. L., 2015, In: Advanced Energy Materials. 5, 22, 9 p., 1500991.

    Research output: Contribution to journal › Journal article › Research › peer-review

  45. Published

    A Monolayer Carbon Nitride on Au(111) with a High Density of Single Co Sites

    Gammelgaard, J. J., Sun, Z., Vestergaard, A. K., Zhao, S., Li, Z., Lock, N., Daasbjerg, K., Bagger, A., Rossmeisl, Jan & Lauritsen, J. V., 2023, In: ACS Nano. 17, 17, p. 17489-17498 10 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  46. Published

    Ligand-Dependent Energetics for Dehydrogenation: Implications in Li-Ion Battery Electrolyte Stability and Selective Oxidation Catalysis of Hydrogen-Containing Molecules

    Giordano, L., Østergaard, T. M., Muy, S., Yu, Y., Charles, N., Kim, S., Zhang, Y., Maglia, F., Jung, R., Lund, I., Rossmeisl, Jan & Shao-horn, Y., 2019, In: Chemistry of Materials. 31, 15, p. 5464-5474

    Research output: Contribution to journal › Journal article › Research › peer-review

  47. Published

    Atomic scale analysis of sterical effects in the adsorption of 4,6-dimethyldibenzothiophene on a CoMoS hydrotreating catalyst

    Gronborg, S. S., Saric, M., Moses, P. G., Rossmeisl, Jan & Lauritsen, J. V., 2016, In: Journal of Catalysis. 344, p. 121-128 8 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  48. Published

    Uncovering the electrochemical interface of low-index copper surfaces in deep groundwater environments

    Halldin Stenlid, J., Campos Dos Santos, E., Arán-ais, R. M., Bagger, A., Johansson, A. J., Roldan Cuenya, B., Rossmeisl, Jan & Pettersson, L. G. M., 1 Dec 2020, In: Electrochimica Acta. 362, 10 p., 137111.

    Research output: Contribution to journal › Journal article › Research › peer-review

  49. Published

    Finite bias calculations to model interface dipoles in electrochemical cells at the atomic scale

    Hansen, M. H., Jin, C., Thygesen, K. S. & Rossmeisl, Jan, 2016, In: The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter. 120, 25, p. 13485-13491 7 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

  50. Published

    Modelling pH and potential in dynamic structures of the water/Pt(111) interface on the atomic scale

    Hansen, M. H., Nilsson, A. & Rossmeisl, Jan, 2017, In: Physical Chemistry Chemical Physics. 19, 34, p. 23505-23514 10 p.

    Research output: Contribution to journal › Journal article › Research › peer-review

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