Publications

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Jaganathan, R., Simonsen, F. D. S., Thrower, J. D. & Hornekaer, L. (2022). Enhanced reactivity of oxygen-functionalised PAHs with atomic hydrogen - A route to the formation of small oxygen-carrying molecules. Astronomy & Astrophysics (A&A), 663, Artikel A136. https://doi.org/10.1051/0004-6361/202243312

Rosu-Finsen, A., Lasne, J., Cassidy, A., McCoustra, M. R. S. & Field, D. (2016). Enabling Star Formation via Spontaneous Molecular Dipole Orientation in Icy Solids. Astrophysical Journal, 832(1), Artikel 1. https://doi.org/10.3847/0004-637X/832/1/1

Abdulgalil, A. G. M., Rosu-Finsen, A., Marchione, D., Thrower, J. D., Collings, M. P. & McCoustra, M. R. S. (2017). Electron-Promoted Desorption from Water Ice Surfaces: Neutral Gas Phase Products. ACS Earth and Space Chemistry, 1(4), 209-215. https://doi.org/10.1021/acsearthspacechem.7b00028

Christian Johannsen, J., Ulstrup, S., Bianchi, M., Hatch, R., Guan, D., Mazzola, F., Hornekær, L., Fromm, F., Raidel, C., Seyller, T. & Hofmann, P. (2013). Electron-phonon coupling in quasi free-standing graphene. Journal of Physics: Condensed Matter, 25, 094001. https://doi.org/10.1088/0953-8984/25/9/094001

Bianchi, M., Rienks, E., Lizzit, S., Baraldi, A., Balog, R., Hornekær, L. & Hofmann, P. (2010). Electron-phonon coupling in potassium-doped graphene: Angle-resolved photoemission spectroscopy. Physical Review B, 81(4), 041403. https://doi.org/10.1103/PhysRevB.81.041403

Ulstrup, S., Nilsson, L., Miwa, J. A., Balog, R., Bianchi, M., Hornekær, L. & Hofmann, P. (2013). Electronic structure of graphene on a reconstructed Pt(100) surface: Hydrogen adsorption, doping, and band gaps. Physical Review B, 88(12). https://doi.org/10.1103/PhysRevB.88.125425

Cassidy, A., Plekan, O., Balog, R., Dunger, J., Field, D. & Jones, N. C. (2014). Electric Field Structures in Thin Films: Formation and Properties. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 118, 6615-6621. https://doi.org/10.1021/jp503332x

Marchione, D., Thrower, J. D. & McCoustra, M. R. S. (2016). Efficient electron-promoted desorption of benzene from water ice surfaces. Physical Chemistry Chemical Physics, 18(5), 4026-4034. https://doi.org/10.1039/c5cp06537b

Cassidy, A., Jørgensen, M. R. V., Rosu-Finsen, A., Lasne, J., Jørgensen, J. H., Glavic, A., Lauter, V., Iversen, B. B., McCoustra, M. R. S. & Field, D. (2016). Dipole-Oriented Molecular Solids Can Undergo a Phase Change and Still Maintain Electrical Polarization. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, 120(42), 24130-24136. https://doi.org/10.1021/acs.jpcc.6b07296

Pantazidis, G., Scheffler, M., Simonsen, F. D. S., Cassidy, A., Jensen, P. A., Hornekær, L. & Thrower, J. D. (2019). Deuteration of C₆₀on a highly oriented pyrolytic graphite surface. Proceedings of the International Astronomical Union, 15(S356), 458-459. https://doi.org/10.1017/S1743921320000344

Thrower, J. D., Burke, D. J., Collings, M. P., Dawes, A., Holtom, P. D., Jamme, F., Kendall, P., Brown, W. A., Clark, I. P., Fraser, H. J., McCoustra, M. R. S., Mason, N. J. & Parker, A. W. (2008). Desorption of hot molecules from photon irradiated interstellar ices. Astrophysical Journal, 673, 1233-1239.

Cassidy, A., James, R. L., Dawes, A. & Field, D. (2020). Crystallites and Electric Fields in Solid Ammonia. ChemistryOpen, 9(10), 983-990. https://doi.org/10.1002/open.202000118

Ng, M. L., Balog, R., Hornekær, L., Preobrajenski, A. B., Vinogradov, N. A., Mårtensson, N. & Schulte, K. (2010). Controlling Hydrogenation of Graphene on Transition Metals. Journal of Physical Chemistry C, 114(43), 18559-18565 . https://doi.org/10.1021/jp106361y

Balog, R., Andersen, M., Jørgensen, B., Sljivancanin, Z., Hammer, B., Baraldi, A., Larciprete, R., Hofmann, P., Hornekær, L. & Lizzit, S. (2013). Controlling Hydrogenation of Graphene on Ir(111). A C S Nano, 7(5), 3823–3832. https://doi.org/10.1021/nn400780x

Slumstrup, L., Thrower, J. D., Hopkinson, A. T., Wenzel, G., Jaganathan, R., Schrauwen, J. G. M., Redlich, B., Ioppolo, S. & Hornekær, L. (2025). CO desorption from interstellar icy grains induced by infrared excitation of superhydrogenated polycyclic aromatic hydrocarbons. Astronomy and Astrophysics, 704, Artikel A74. https://doi.org/10.1051/0004-6361/202556399

Hornekær, L., Rauls, E., Xu, W., Sljivancanin, Z., Otero, R., Stensgaard, I., Lægsgaard, E., Hammer, B. & Besenbacher, F. (2006). Clustering of Chemisorbed H(D) Atoms on the Graphite (0001) Surface due to Preferential Sticking. Physical Review Letters, 97, 186102.

Jorgensen, A. L., Duncan, D. A., Kastorp, C. F. P., Kyhl, L., Tang, Z., Bruix, A., Andersen, M., Hammer, B., Lee, T.-L., Hornekaer, L. & Balog, R. (2019). Chemically-resolved determination of hydrogenated graphene-substrate interaction. Physical Chemistry Chemical Physics, 21(25), 13462-13466. https://doi.org/10.1039/c9cp02059d

Camilli, L., Yu, F., Cassidy, A., Hornekær, L. & Bøggild, P. (2019). Challenges for continuous graphene as a corrosion barrier. 2D materials, 6(2), Artikel 022002. https://doi.org/10.1088/2053-1583/ab04d4

Rauls, E. & Hornekær, L. (2008). Catalyzed routes to molecular hydrogen formation and hydrogen addition reactions on neutral polycyclic aromatic hydrocarbons under interstellar conditions. Astrophysical Journal, 679, 531-536.

Nilsson, L., Andersen, M., Hammer, B., Stensgaard, I. & Hornekær, L. (2013). Breakdown of the Graphene Coating Effect under Sequential Exposure to O₂ and H₂S. The Journal of Physical Chemistry Letters, 4(21), 3770-3774. https://doi.org/10.1021/jz402054e

Leccese, M., Jaganathan, R., Slumstrup, L., Thrower, J. D., Hornekær, L. & Martinazzo, R. (2023). Bending the rules of PAH hydrogenation: the case of corannulene. Monthly Notices of the Royal Astronomical Society, 519(4), 5567-5578. https://doi.org/10.1093/mnras/stad054

Gronborg, S. S., Thorarinsdottir, K., Kyhl, L., Rodriguez-Fernández, J., Sanders, C. E., Bianchi, M., Hofmann, P., Miwa, J. A., Ulstrup, S. & Lauritsen, J. V. (2019). Basal plane oxygen exchange of epitaxial MoS₂ without edge oxidation. 2D materials, 6(4), Artikel 045013. https://doi.org/10.1088/2053-1583/ab2d00

Balog, R., Jørgensen, B., Nilsson, L., Andersen, M., Rienks, E., Bianchi, M., Fanetti, M., Lægsgaard, E., Baraldi, A., Lizzit, S., Sljivancanin, Z., Besenbacher, F., Hammer, B., Pedersen, T. G., Hofmann, P. & Hornekær, L. (2010). Bandgap opening in graphene induced by patterned hydrogen adsorption. Nature Materials, 9, 315-319. https://doi.org/10.1038/NMAT2710

Balog, R., Jørgensen, B., Wells, J., Lægsgaard, E., Hofmann, P., Besenbacher, F. & Hornekær, L. (2009). Atomic hydrogen adsorbate structures on graphene. Journal of the American Chemical Society, 131(25), 8744. https://doi.org/10.1021/ja902714h

Zhang, J., Traspas Muiña, A., Mifsud, D. V., Kaňuchová, Z., Cielinska, K., Herczku, P., Rahul, K. K., Kovács, S. T. S., Rácz, R., Santos, J. C., Hopkinson, A. T., Craciunescu, L., Jones, N. C., Hoffmann, S. V., Biri, S., Vajda, I., Rajta, I., Dawes, A., Sivaraman, B. ... Ioppolo, S. (2024). A systematic IR and VUV spectroscopic investigation of ion, electron, and thermally processed ethanolamine ice. Monthly Notices of the Royal Astronomical Society, 533(1), 826-840. https://doi.org/10.1093/mnras/stae1860

Roman, M., Dunn, A., Taj, S., Keolopile, Z. G., Rosu-Finsen, A., Gutowski, M., McCoustra, M. R. S., Cassidy, A. M. & Field, D. (2018). Assigning a structural motif using spontaneous molecular dipole orientation in thin films. Physical Chemistry Chemical Physics, 10(46), 29038-29044. https://doi.org/10.1039/c8cp06010j

Cassidy, A., McCoustra, M. R. S. & Field, D. (2023). A Spontaneously Electrical State of Matter. Accounts of Chemical Research, 56(14), 1909-1919. https://doi.org/10.1021/acs.accounts.3c00094

Plekan, O., Rosu-Finsen, A., Cassidy, A. M., Lasne, J., McCoustra, M. R. S. & Field, D. (2017). A review of recent progress in understanding the spontelectric state of matter. The European Physical Journal D: Atomic, Molecular, Optical and Plasma Physics, 71(6), Artikel 162. https://doi.org/10.1140/epjd/e2017-80048-3

Hopkinson, A. T., Wilson, A. M., Pitfield, J., Muiña, A. T., Rácz, R., Mifsud, D. V., Herczku, P., Lakatos, G., Sulik, B., Juhász, Z., Biri, S., McCullough, R. W., Mason, N. J., Scavenius, C., Hornekær, L. & Ioppolo, S. (2026). An interstellar energetic and non-aqueous pathway to peptide formation. Nature Astronomy, 10(4), 531-539. https://doi.org/10.1038/s41550-025-02765-7

Tang, Z., Doktor, F. G., Jaganathan, R., Palotás, J., Oomens, J., Hornekær, L. & Hammer, B. (2025). Anharmonic infrared spectra of cationic pyrene and superhydrogenated derivatives. Journal of Chemical Physics, 163(4), Artikel 044304. https://doi.org/10.1063/5.0276133

Powis, I., Thrower, J. D., Trofimov, A. B., Moskovskaya, T. E., Schirmer, J., Potts, A. W., M P Holland, D., Bruhn, F. & Karlsson, L. (2005). An experimental and theoretical study of the photoelectron spectrum of hydrogen selenide. Chemical Physics, 315, 121-132.

Plekan, O., Cassidy, A., Balog, R., Jones, N. C. & Field, D. (2011). A new form of spontaneously polarized material. Physical Chemistry Chemical Physics, 13, 21035-21044. https://doi.org/10.1039/C1CP22310K

Liu, L., Ji, Y., Bianchi, M., Hus, S. M., Li, Z., Balog, R., Miwa, J. A., Hofmann, P., Li, A. P., Zemlyanov, D. Y., Li, Y. & Chen, Y. P. (2024). A metastable pentagonal 2D material synthesized by symmetry-driven epitaxy. Nature Materials, 23(10), 1339-1346. https://doi.org/10.1038/s41563-024-01987-w

Cassidy, A., Jørgensen, M. R. V., Glavic, A., Lauter, V., Plekan, O. & Field, D. (2021). A mechanism for ageing in a deeply supercooled molecular glass. Chemical Communications, 57(52), 6368-6371. https://doi.org/10.1039/d1cc01639c

Trotochaud, L., Head, A. R., Karslioglu, O., Hansen, L. K. & Bluhm, H. (2017). Ambient pressure photoelectron spectroscopy: Practical considerations and experimental frontiers. Journal of Physics: Condensed Matter, 29(5), Artikel 053002. https://doi.org/10.1088/1361-648X/29/5/053002

Gavardi, E., Cuppen, H. M. & Hornekær, L. (2009). A kinetic Monte Carlo study of desorption of H₂ from graphite (0001). Chemical Physics Letters, 477(4-6), 285–289. https://doi.org/10.1016/j.cplett.2009.07.003

Head, A. R., Tsyshevsky, R., Trotochaud, L., Yu, Y., Hansen, L. K., Karslioglu, O., Kuklja, M. M. & Bluhm, H. (2016). Adsorption of Dimethyl Methylphosphonate on MoO3: The Role of Oxygen Vacancies. The Journal of Physical Chemistry Part C, 120(51), 29077-29088. https://doi.org/10.1021/acs.jpcc.6b07340

Cassidy, A., Tsud, N., Bercha, S., Feyer, V., Prince, K. C. & Plekan, O. (2019). Adsorption of 5-Fluorouracil on Au(111) and Cu(111) surfaces. AIP Advances, 9(8), Artikel 5108801. https://doi.org/10.1063/1.5108801

Dappe, Y. J., Andersen, M., Balog, R., Hornekær, L. & Bouju, X. (2015). Adsorption and STM imaging of polycyclic aromatic hydrocarbons on graphene. Physical Review B, 91(4), Artikel 045427. https://doi.org/10.1103/PhysRevB.91.045427

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Revideret 29.01.2024