Publications 2018

[1] Squibb, R. J., Sapunar, M., Ponzi, A., Richter, R., Kivimaki, A., Plekan, O., Finetti, P., Sisourat, N., Zhaunerchyk, V., Marchenko, T., Journel, L., Guillemin, R., Cucini, R., Coreno, M., CNR, I. S. M., Grazioli, C., CNR, I. S. M., Di Fraia, M., CNR, I. S. M., Callegari, C., CNR, I. S. M., Prince, K. C., Swinburne Univ Technol, D. C. &. B., Decleva, P., Univ Trieste, D. S. C. &. F., Simon, M., Eland, J. H. D., Univ Oxford, D. C., Doslic, N., Feifel, R., Piancastelli, M. N., “Acetylacetone photodynamics at a seeded free-electron laser”, Nature Communications 9, , (2018). DOI:10.1038/s41467-017-02478-0
[2] Farstad, M. H., Ragazzon, D., Strømsheim, M. D., Gustafson, J., Sandell, A., Borg, A., “Oxidation and Reduction of TiOx Thin Films on Pd(111) and Pd(100)”, Journal of Physical Chemistry B 122, 688--694, (2018). DOI:10.1021/acs.jpcb.7b06282
[3] Guillemin, R., Orme Merisiers, S. S., Jänkälä, K., de Miranda, B. C., Marin, T., Journel, L., Orme Merisiers, S. S., Marchenko, T., Orme Merisiers, S. S., Travnikova, O., Orme Merisiers, S. S., Goldsztejn, G., Ismail, I., Püttner, R., Céolin, D., Lassalle-Kaiser, B., Piancastelli, M. N., Simon, M., Orme Merisiers, S. S., “Interplay of complex decay processes after argon 1s ionization”, Physical Review A: covering atomic, molecular, and optical physics and quantum information 97, , (2018). DOI:10.1103/PhysRevA.97.013418
[4] Guillemin, R., Orme Merisiers, S. S., Jänkälä, K., de Miranda, B. C., Marin, T., Journel, L., Orme Merisiers, S. S., Marchenko, T., Orme Merisiers, S. S., Travnikova, O., Orme Merisiers, S. S., Goldsztejn, G., Ismail, I., Püttner, R., Céolin, D., Lassalle-Kaiser, B., Piancastelli, M. N., Simon, M., Orme Merisiers, S. S., “Interplay of complex decay processes after argon 1s ionization”, Physical Review A: covering atomic, molecular, and optical physics and quantum information 97, , (2018). DOI:10.1103/PhysRevA.97.013418
[5] Koulentianos, D., UPMC Univ Paris 06, C., Püttner, R., Goldsztejn, G., Max Born Inst, M. B. S. 2., Marchenko, T., LOrme Merisiers, S. S., Travnikova, O., LOrme Merisiers, S. S., Journel, L., LOrme Merisiers, S. S., Guillemin, R., LOrme Merisiers, S. S., Céolin, D., Piancastelli, M. N., Simon, M., LOrme Merisiers, S. S., Feifel, R., “KL double core hole pre-edge states of HCl”, Physical Chemistry, Chemical Physics – PCCP 20, 2724--2730, (2018). DOI:10.1039/c7cp04214k
[6] Capron, N., CNRS, L. C. P. M. &. R., Casier, B., CNRS, L. C. P. M. &. R., Sisourat, N., CNRS, L. C. P. M. &. R., Piancastelli, M. N., CNRS, L. C. P. M. &. R., Simon, M., CNRS, L. C. P. M. &. R., Carniato, S., CNRS, L. C. P. M. &. R., “Correction: Probing keto–enol tautomerism using photoelectron spectroscopy”, Physical Chemistry, Chemical Physics – PCCP 20, 695--695, (2018). DOI:10.1039/c7cp90269g
[7] Maitra, U., House, R., Somerville, J., Tapia-Ruiz, N., Lozano, J., Guerrini, N., Hao, R., Luo, K., Jin, L., Pérez-Osorio, M., Massel, F., Pickup, D., Ramos, S., Lu, X., McNally, D., Chadwick, A., Giustino, F., Schmitt, T., Duda, L., Roberts, M., Bruce, P., “Oxygen redox chemistry without excess alkali-metal ions in Na2/3[Mg0.28Mn0.72]O2”, Nature Chemistry 10, 288--295, (2018). DOI:10.1038/nchem.2923
[8] Simonov, K., St Petersburg State Univ, V. F. I. P., Generalov, A. V., Vinogradov, A. S., Svirskiy, G. I., Cafolla, A. A., McGuinness, C., Taketsugu, T., NIMS, G. R. C. E. &. E. B. N. S., Lyalin, A., Mårtensson, N., Preobrajenski, A. B., “Synthesis of armchair graphene nanoribbons from the 10,10 '-dibromo-9,9 '-bianthracene molecules on Ag(111): the role of organometallic intermediates”, Scientific Reports 8, , (2018). DOI:10.1038/s41598-018-21704-3
[9] Matt, C. E., Paul Scherrer Inst, S. L. S., Sutter, D., Cook, A. M., Sassa, Y., Månsson, M., Tjernberg, O., Das, L., Horio, M., Destraz, D., Fatuzzo, C. G., Hauser, K., Shi, M., Kobayashi, M., Strocov, V. N., Schmitt, T., Dudin, P., Hoesch, M., Pyon, S., Takayama, T., Takagi, H., Lipscombe, O. J., Hayden, S. M., Kurosawa, T., Momono, N., Muroran Inst Technol, D. A. S., Oda, M., Neupert, T., Chang, J., “Direct observation of orbital hybridisation in a cuprate superconductor”, Nature Communications 9, , (2018). DOI:10.1038/s41467-018-03266-0
[10] Nilsson, J. O., Leetmaa, M., Wang, B., Chalmers Univ Technol, C. C. C., Zguns, P. A., Pasti, I., Sandell, A., Skorodumova, N. V., “Modeling Kinetics of Water Adsorption on the Rutile TiO2 (110) Surface: Influence of Exchange-Correlation Functional”, Physica status solidi. B, Basic research 255, , (2018). DOI:10.1002/pssb.201700344
[11] Sveinbjörnsson, K., Kyi Thein, N. K., Saki, Z., Svanström, S., Yang, W., Cappel, U. B., Rensmo, H., Boschloo, G., Aitola, K., Johansson, E., “Preparation of mixed-ion and inorganic perovskite films using water and isopropanol as solvents for solar cell applications”, Sustainable Energy & Fuels 2, 606--615, (2018). DOI:10.1039/C7SE00538E
[12] Dankert, A., Bhaskar, P., Khokhriakov, D., Rodrigues, I. H., Karpiak, B., Kamalakar, M. V., Charpentier, S., Garate, I., Dash, S. P., “Origin and evolution of surface spin current in topological insulators”, Physical Review B 97, , (2018). DOI:10.1103/PhysRevB.97.125414
[13] Svirskiy, G. I., Generalov, A. V., Lund Univ, M. L. 4., Klyushin, A. Y., Helmholtz Zentrum Berlin, R. G. C. E., Max Planck Gesell, D. I. C., Simonov, K., Lund Univ, M. L. 4., Krasnikov, S. A., Dublin City Univ, S. P. S., Vinogradov, N. A., Lund Univ, M. L. 4., Trigub, A. L., Zubavichus, Y. V., Preobrazhenski, A. B., Lund Univ, M. L. 4., Vinogradov, A. S., “Comparative X-Ray Absorption Analysis of the Spectrum of Vacant Electronic States in Cobalt and Nickel Tetraphenylporphyrin Complexes”, Physics of the solid state 60, 581--591, (2018). DOI:10.1134/S1063783418030307
[14] Abdi-Jalebi, M., Andaji-Garmaroudi, Z., Cacovich, S., Stavrakas, C., Philippe, B., Richter, J. M., Alsari, M., Booker, E. P., Hutter, E. M., Pearson, A. J., Lilliu, S., Savenije, T. J., Rensmo, H., Divitini, G., Ducati, C., Friend, R. H., Stranks, S. D., “Maximizing and stabilizing luminescence from halide perovskites with potassium passivation”, Nature 555, 497--501, (2018). DOI:10.1038/nature25989
[15] Fasshauer, E., Förstel, M., Tech Univ Berlin, I. O. &. A. P., Mucke, M., Arion, T., DESY, C. F. E. L. S., Hergenhahn, U., Max Planck Inst Plasma Phys, G., “Corrigendum to “Theoretical and experimental investigation of Electron Transfer Mediated Decay in ArKr clusters” [Chem. Phys. 482 (2017) 226–238]”, Chemical Physics 501, 138--138, (2018). DOI:10.1016/j.chemphys.2018.01.022
[16] Paul, S., Iusan, D., Thunström, P., Kvashnin, Y., Hellsvik, J., Pereiro, M., Delin, A., KTH Royal Inst Technol, S., Knut, R., Phuyal, D., Lindblad, A., Karis, O., Sanyal, B., Eriksson, O., “Investigation of the spectral properties and magnetism of BiFeO3 by dynamical mean-field theory”, Physical Review B 97, , (2018). DOI:10.1103/PhysRevB.97.125120
[17] Shaw, J. M., Delczeg-Czirjak, E. K., Edwards, E. R. J., Kvashnin, Y., Thonig, D., Schoen, M. A. W., Univ Regensburg, D. P., Pufall, M., Schneider, M. L., Silva, T. J., Karis, O., Rice, K. P., Olle, E., Nembach, H. T., “Magnetic damping in sputter-deposited Co2MnGe Heusler compounds with A2, B2, and L21 orders: Experiment and theory”, Physical Review B 97, , (2018). DOI:10.1103/PhysRevB.97.094420
[18] Schalk, O., Josefsson, I., Geng, T., Richter, R., Sa'adeh, H., Thomas, R. D., Mucke, M., “Dissociation kinetics of excited ions: PEPICO measurements of Os3(CO)12 – The 7-35 eV single ionization binding energy region”, Journal of Chemical Physics 148, , (2018). DOI:10.1063/1.5018719
[19] Giangrisostomi, E., Ovsyannikov, R., Sorgenfrei, F., Zhang, T., Lindblad, A., Sassa, Y., Cappel, U. B., Leitner, T., Mitzner, R., Svensson, S., Mårtensson, N., Föhlisch, A., Univ Potsdam, I. P. &. A., “Low Dose Photoelectron Spectroscopy at BESSY II : Electronic structure of matter in its native state”, Journal of Electron Spectroscopy and Related Phenomena 224, 68--78, (2018). DOI:10.1016/j.elspec.2017.05.011
[20] Kühn, D., Helmholtz Zentrum Berlin Mat & Energie GmbH, A. E. S. 1., Sorgenfrei, F., Helmholtz Zentrum Berlin Mat & Energie GmbH, A. E. S. 1., Giangrisostomi, E., Jay, R., Musazay, A., Ovsyannikov, R., Stråhlman, C., Malmö Univ, S. M., Svensson, S., Mårtensson, N., Föhlisch, A., Helmholtz Zentrum Berlin Mat & Energie GmbH, A. E. S. 1., “Capabilities of Angle Resolved Time of Flight electron spectroscopy with the 60 degrees wide angle acceptance lens”, Journal of Electron Spectroscopy and Related Phenomena 224, 45--50, (2018). DOI:10.1016/j.elspec.2017.06.008
[21] Sassa, Y., Månsson, M., Forslund, O. K., Tjernberg, O., Pomjakushin, V., Ofer, O., Ansaldo, E. J., Brewer, J. H., Umegaki, I., Higuchi, Y., Ikedo, Y., KEK, M. S. L., Nozaki, H., Harada, M., Watanabe, I., Sakurai, H., Sugiyama, J., “The metallic quasi-1D spin-density-wave compound NaV2O4 studied by angle-resolved photoelectron spectroscopy”, Journal of Electron Spectroscopy and Related Phenomena 224, 79--83, (2018). DOI:10.1016/j.elspec.2017.05.010
[22] Magnuson, M., Schmitt, T., Duda, L., “Polarization-dependent resonant inelastic X-ray scattering study at the Cu L and O K-edges of YBa2Cu3O7-x”, Journal of Electron Spectroscopy and Related Phenomena 224, 38--44, (2018). DOI:10.1016/j.elspec.2017.07.005
[23] Stefanuik, R., Knut, R., Jana, S., Terschlüsen, J. A., Sandell, A., Söderström, J., “Developments and enhancements to the HELIOS pump probe system”, Journal of Electron Spectroscopy and Related Phenomena 224, 33--37, (2018). DOI:10.1016/j.elspec.2017.09.004
[24] Massel, F., Ahmadi, S., Hahlin, M., Liu, Y., Guo, J. -. .. , Edvinsson, T., Rensmo, H., Duda, L., “Transition metal doping effects in Co-phosphate catalysts for water splitting studied with XAS”, Journal of Electron Spectroscopy and Related Phenomena , 3--7, (2018). DOI:10.1016/j.elspec.2017.09.012
[25] Yang, L., Schölin, R., Gabrielsson, E., Boschloo, G., Rensmo, H., Sun, L., Hagfeldt, A., Edvinsson, T., Johansson, E. M. J., “Experimental and Theoretical Investigation of the Function of 4-tert-Butyl Pyridine for Interface Energy Level Adjustment in Efficient Solid-State Dye-Sensitized Solar Cells”, ACS Applied Materials and Interfaces 10, 11572--11579, (2018). DOI:10.1021/acsami.7b16877
[26] Cochrane, K. A., Univ British Columbia, S. B. Q. M. I., Roussy, T. S., Yuan, B., Tom, G., Univ British Columbia, S. B. Q. M. I., Marsell, E., Burke, S. A., Univ British Columbia, D. P. &. A., Univ British Columbia, S. B. Q. M. I., “Molecularly Resolved Electronic Landscapes of Differing-Acceptor-Donor Interface Geometries”, The Journal of Physical Chemistry C 122, 8437--8444, (2018). DOI:10.1021/acs.jpcc.8b01396
[27] Pal, S., Govinda, S., Goyal, M., Mukherjee, S., Pal, B., Saha, R., Sundaresan, A., Jana, S., Karis, O., Freeland, J. W., Sarma, D. D., Jawaharlal Nehru Ctr Adv Sci Res, B., “Effect of anti-site disorder on magnetism in La2NiMnO6”, Physical Review B 97, , (2018). DOI:10.1103/PhysRevB.97.165137
[28] Jönsson, O., Östlin, C., Scott, H. A., Chapman, H., Aplin, S. J., Timneanu, N., Caleman, C., “FreeDam – A Webtool for Free-Electron Laser-Induced Damage in Femtosecond X-ray Crystallography”, High Energy Density Physics 26, 93--98, (2018). DOI:
[29] House, R. A., Univ Oxford, D. C., Jin, L., Univ Oxford, D. C., Maitra, U., Univ Oxford, D. C., Tsuruta, K., Somerville, J. W., Univ Oxford, D. C., Förstermann, D. P., Univ Oxford, D. C., Massel, F., Duda, L., Roberts, M. R., Univ Oxford, D. C., Bruce, P. G., Univ Oxford, D. C., “Lithium manganese oxyfluoride as a new cathode material exhibiting oxygen redox”, Energy & Environmental Science 11, 926--932, (2018). DOI:10.1039/c7ee03195e
[30] Brasse, F., Goldsztejn, G., Amini, K., Boll, R., Bari, S., Bomme, C., Brouard, M., Burt, M., de Miranda, B. C., Düsterer, S., Erk, B., Geleoc, M., Geneaux, R., Gentleman, A. S., Guillemin, R., Ismail, I., Johnsson, P., Journel, L., Kierspel, T., Univ Hamburg, C. U. I., Köckert, H., Küpper, J., Univ Hamburg, C. U. I., Univ Hamburg, D. P., Lablanquie, P., Lahl, J., Lee, J. W. L., Mackenzie, S. R., Maclot, S., Manschwetus, B., Mereshchenko, A. S., Mullins, T., Olshin, P. K., Palaudoux, J., Patchkovskii, S., Penent, F., Piancastelli, M. N., Rompotis, D., Ruchon, T., Rudenko, A., Savelyev, E., Schirmel, N., Techert, S., Max Planck Inst Biophys Chem, D. G., Göttingen Univ, I. X. P., Travnikova, O., Trippel, S., Univ Hamburg, C. U. I., Underwood, J. G., Vallance, C., Wiese, J., Simon, M., Holland, D. M. P., Marchenko, T., Rouzée, A., Rolles, D., “Time-resolved inner-shell photoelectron spectroscopy: From a bound molecule to an isolated atom”, Physical Review A: covering atomic, molecular, and optical physics and quantum information 97, , (2018). DOI:10.1103/PhysRevA.97.043429
[31] Cappel, U. B., Liu, P., Johansson, F., Philippe, B., Giangrisostomi, E., Ovsyannikov, R., Lindblad, A., Kloo, L., Gardner, J. M., Rensmo, H., “Electronic Structure Characterization of Cross-Linked Sulfur Polymers”, ChemPhysChem 19, 1041--1047, (2018). DOI:10.1002/cphc.201800043
[32] Schaefer, A., Chalmers Univ Technol, C. C. C., Lanzilotto, V., Cappel, U. B., Uvdal, P., Borg, A., Sandell, A., “First layer water phases on anatase TiO2(101)”, Surface Science 674, 25--31, (2018). DOI:10.1016/j.susc.2018.03.019
[33] Östlin, C., Timneanu, N., Jönsson, H. O., Ekeberg, T., Martin, A. V., Caleman, C., “Reproducibility of Single Protein Explosions Induced by X-ray Lasers”, Physical Chemistry, Chemical Physics – PCCP 20, 12381--12389, (2018). DOI:10.1039/C7CP07267H
[34] Ray, S. J., Kamalakar, M. V., “Unconventional strain-dependent conductance oscillations in pristine phosphorene”, Physical Chemistry, Chemical Physics – PCCP 20, 13508--13516, (2018). DOI:10.1039/c8cp01620h
[35] Beyerlein, K., Jönsson, O., Alonso-Mori, R., Aquila, A., Bajt, S., Barty, A., Bean, R., Koglin, J. E., Messerschmidt, M., Ragazzon, D., Sokaras, D., Williams, G. J., Hau-Riege, S., Boutet, S., Chapman, H. N., Department of Physics, U. o. H., Centre for Ultrafast Imaging, U. o. H., Timneanu, N., Caleman, C., “Ultrafast non-thermal heating of water initiated by an X-ray laser”, Proceedings of the National Academy of Sciences of the United States of America 115, 5652--5657, (2018). DOI:10.1073/pnas.1711220115
[36] Ekholm, V., Vazdar, M., Mason, P. E., Bialik, E., Walz, M., Öhrwall, G., Werner, J., Rubensson, J., Jungwirth, P., Björneholm, O., “Anomalous surface behavior of hydrated guanidinium ions due to ion pairing”, Journal of Chemical Physics 148, , (2018). DOI:10.1063/1.5024348
[37] Chernysheva, E., Sorbonne Univ, C., Srour, W., Philippe, B., Baris, B., Chenot, S., Felix Duarte, R., Gorgoi, M., Cruguel, H., Rensmo, H., Montigaud, H., Jupille, J., Cabailh, G., Grachev, S., Lazzari, R., “Band alignment at Ag/ZnO(0001) interfaces: A combined soft and hard x-ray photoemission study”, Physical Review B 97, , (2018). DOI:10.1103/PhysRevB.97.235430
[38] Jiang, S., NanOsc AB, S. K., Chung, S., Diez, L. H., Le, T. Q., Magnusson, F., Ravelosona, D., Spin Ion Technol, 2. R. G. L., Åkerman, J., NanOsc AB, S. K., Univ Gothenburg, D. P., “Tuning the magnetodynamic properties of all-perpendicular spin valves using He+ irradiation”, AIP Advances 8, , (2018). DOI:10.1063/1.5024472
[39] Berger, A. J., Edwards, E. R. J., Nembach, H. T., Karis, O., Weiler, M., Bayerische Akad Wissensch, W. M. I., Silva, T. J., “Determination of the spin Hall effect and the spin diffusion length of Pt from self-consistent fitting of damping enhancement and inverse spin-orbit torque measurements”, Physical Review B 98, , (2018). DOI:10.1103/PhysRevB.98.024402
[40] Johansson, F., Ivanovic, M., Svanström, S., Cappel, U. B., Peisert, H., Chasse, T., Lindblad, A., “Femtosecond and Attosecond Electron-Transfer Dynamics in PCPDTBT: PCBM Bulk Heterojunctions”, The Journal of Physical Chemistry C 122, 12605--12614, (2018). DOI:10.1021/acs.jpcc.8b02453
[41] Gorkhover, T., Ulmer, A., Ferguson, K., Bucher, M., Maia, F. R. N. C., Bielecki, J., Ekeberg, T., Hantke, M. F., Daurer, B. J., Nettelblad, C., Andreasson, J., Barty, A., Bruza, P., Carron, S., Hasse, D., Krzywinski, J., Larsson, D. S. D., Morgan, A., Mühlig, K., Müller, M., Okamoto, K., Pietrini, A., Rupp, D., Sauppe, M., van der Schot, G., Seibert, M., Sellberg, J. A., Svenda, M., Swiggers, M., Timneanu, N., Westphal, D., Williams, G., Zani, A., Chapman, H. N., Faigel, G., Möller, T., Hajdu, J., Bostedt, C., “Femtosecond X-ray Fourier holography imaging of free-flying nanoparticles”, Nature Photonics 12, 150--153, (2018). DOI:10.1038/s41566-018-0110-y
[42] Ismail, I., Guillemin, R., Marchenko, T., Travnikova, O., Ablett, J. M., Rueff, J. -., Piancastelli, M. N., Simon, M., UPMC Univ Paris 06, S. U., Journel, L., “Experimental setup for the study of resonant inelastic X-ray scattering of organometallic complexes in gas phase”, Review of Scientific Instruments 89, , (2018). DOI:10.1063/1.5021536
[43] Karaush, N. N., Minaeva, V. A., Baryshnikov, G. V., Bohdan Khmelnytsky Natl Univ, D. C. &. N. S., Minaev, B. F., Bohdan Khmelnytsky Natl Univ, D. C. &. N. S., Ågren, H., “Identification of tautomeric intermediates of a novel thiazolylazonaphthol dye – A density functional theory study”, Spectrochimica Acta Part A  Molecular and Biomolecular Spectroscopy 203, 324--332, (2018). DOI:10.1016/j.saa.2018.05.096
[44] Bes, R., Kvashnina, K., Helmholtz Zentrum Dresden Rossendorf HZDR, I. R. E., Rossberg, A., Helmholtz Zentrum Dresden Rossendorf HZDR, I. R. E., Dottavio, G., Desgranges, L., Pontillon, Y., Solari, P. L., Butorin, S., Martin, P., “New insight in the uranium valence state determination in UyNd1-yO2+/-x”, Journal of Nuclear Materials 507, 145--150, (2018). DOI:10.1016/j.jnucmat.2018.04.046
[45] Kvashnina, K. O., ESRF, R. B., Kowalski, P. M., Forschungszentrum Jülich, N. W. M. &. R. S., Butorin, S., Leinders, G., Pakarinen, J., Bes, R., Li, H., Forschungszentrum Jülich, N. W. M. &. R. S., Verwerft, M., “Trends in the valence band electronic structures of mixed uranium oxides”, Chemical Communications 54, 9757--9760, (2018). DOI:10.1039/c8cc05464a
[46] Karaush, N. N., Baryshnikov, G. V., Bogdan Khmelnitsky Natl Univ, D. C. &. N. S., Ågren, H., Minaev, B. F., “A theoretical study of new representatives of closed- and open-circle benzofuran and benzocyclopentadienone oligomers”, New Journal of Chemistry 42, 11493--11505, (2018). DOI:10.1039/c8nj00601f
[47] Lindblad, R., Oscarsson, J., Fredin, K., Eriksson, S. K., Siegbahn, H., Johansson, E. M. J., Rensmo, H., “Controlling energy level positions in hole conducting molecular films by additives”, Journal of Electron Spectroscopy and Related Phenomena 224, 100--106, (2018). DOI:10.1016/j.elspec.2017.03.009
[48] Zhang, T., Brumboiu, I. E., Grazioli, C., Guarnaccio, A., Coreno, M., de Simone, M., Santagata, A., Rensmo, H., Brena, B., Lanzilotto, V., Puglia, C., “Lone-Pair Delocalization Effects within Electron Donor Molecules: The Case of Triphenylamine and Its Thiophene-Analog”, The Journal of Physical Chemistry C 122, 17706--17717, (2018). DOI:10.1021/acs.jpcc.8b06475
[49] Schaefer, A., Chalmers Univ Technol, D. C. &. C. E., Lanzilotto, V., Cappel, U. B., Uvdal, P., Borg, A., Sandell, A., “Defect-Induced Water Bilayer Growth on Anatase TiO2(101)”, Langmuir 34, 10856--10864, (2018). DOI:10.1021/acs.langmuir.8b01925
[50] Horio, M., Matt, C. E., Harvard Univ, D. P., Paul Scherrer Inst, S. L. S., Kramer, K., Sutter, D., Cook, A. M., Sassa, Y., Hauser, K., Månsson, M., Plumb, N. C., Shi, M., Lipscombe, O. J., Hayden, S. M., Neupert, T., Chang, J., “Two-dimensional type-II Dirac fermions in layered oxides”, Nature Communications 9, , (2018). DOI:10.1038/s41467-018-05715-2
[51] Baryshnikov, G. V., Sunchugashev, D. A., Valiev, R. R., Minaev, B. F., Ågren, H., “Vibronic absorption spectra of the angular fused bisindolo- and biscarbazoloanthracene blue fluorophores for OLED applications”, Chemical Physics 513, 105--111, (2018). DOI:10.1016/j.chemphys.2018.07.023
[52] Horio, M., Hauser, K., Sassa, Y., Mingazheva, Z., Sutter, D., Kramer, K., Cook, A., Nocerino, E., Forslund, O. K., Tjernberg, O., Kobayashi, M., Chikina, A., Schröter, N. B. M., Krieger, J. A., Swiss Fed Inst Technol, L. F., Schmitt, T., Strocov, V. N., Pyon, S., Takayama, T., Takagi, H., Lipscombe, O. J., Hayden, S. M., Ishikado, M., Eisaki, H., Neupert, T., Månsson, M., Matt, C. E., Paul Scherrer Inst, S. L. S., Harvard Univ, D. P., Chang, J., “Three-Dimensional Fermi Surface of Overdoped La-Based Cuprates”, Physical Review Letters 121, , (2018). DOI:10.1103/PhysRevLett.121.077004
[53] Kukk, E., Thomas, T. D., Céolin, D., Granroth, S., Travnikova, O., Berholts, M., Univ Tartu, D. P., Marchenko, T., Guillemin, R., Journel, L., Ismail, I., Püttner, R., Piancastelli, M. N., Ueda, K., Simon, M., Sorbonne Univ, C., “Energy Transfer into Molecular Vibrations and Rotations by Recoil in Inner-Shell Photoemission”, Physical Review Letters 121, , (2018). DOI:10.1103/PhysRevLett.121.073002
[54] Arul Murugan, N., Zalesny, R., Ågren, H., “Unusual binding-site-specific photophysical properties of a benzothiazole-based optical probe in amyloid beta fibrils”, Physical Chemistry, Chemical Physics  PCCP 20, 20334--20339, (2018). DOI:10.1039/C8CP03274B
[55] Jain, S. M., Phuyal, D., Davies, M. L., Li, M., Soochow Univ, I. F. N. &. S. M., Philippe, B., De Castro, C., Qiu, Z., Kim, J., Imperial Coll London, C. P. E., Watson, T., Tsoi, W. C., Karis, O., Rensmo, H., Boschloo, G., Edvinsson, T., Durrant, J. R., Imperial Coll London, D. C., Imperial Coll London, C. P. E., “An effective approach of vapour assisted morphological tailoring for reducing metal defect sites in lead-free, (CH3NH3)3Bi2I9 bismuth-based perovskite solar cells for improved performance and long-term stability”, Nano Energy 49, 614--624, (2018). DOI:10.1016/j.nanoen.2018.05.003
[56] Zhang, X., Zhang, J., Phuyal, D., Du, J., Tian, L., Öberg, V. A., Johansson, M. B., Cappel, U. B., Karis, O., Liu, J., Rensmo, H., Boschloo, G., Johansson, E. M. J., “Inorganic CsPbI3 Perovskite Coating on PbS Quantum Dot for Highly Efficient and Stable Infrared Light Converting Solar Cells”, Advanced Energy Materials 8, , (2018). DOI:10.1002/aenm.201702049
[57] Jesus Luque, F., Kowalik, I. A., Pablo Prieto-Ruiz, J., Angel Nino, M., Prima-Garcia, H., Manuel Romero, F., Arvanitis, D., Coronado, E., Miranda, R., IMDEA Nanosci, M. 2., Univ Autonoma Madrid, D. F. M. C., Jose de Miguel, J., Univ Autonoma Madrid, D. F. M. C., Univ Autonoma Madrid, I. F. M. N. C., “Magnetic ordering in an (Fe0.2Cr0.8)1.5[Cr(CN)6] Prussian blue analogue studied with synchrotron radiation based spectroscopies”, Journal of Materials Chemistry C 6, 8171--8186, (2018). DOI:10.1039/c8tc02879f
[58] Lundholm, I. V., Sellberg, J. A., Ekeberg, T., Hantke, M. F., Okamoto, K., van der Schot, G., Andreasson, J., Barty, A., Bielecki, J., Bruza, P., Bucher, M., Carron, S., Daurer, B. J., Ferguson, K., Hasse, D., Krzywinski, J., Larsson, D. S. D., Morgan, A., Mühlig, K., Müller, M., Nettelblad, C., Pietrini, A., Reddy, H. K. N., Rupp, D., Sauppe, M., Seibert, M., Svenda, M., Swiggers, M., Timneanu, N., Ulmer, A., Westphal, D., Williams, G., Zani, A., Faigel, G., Chapman, H. N., Möller, T., Bostedt, C., Hajdu, J., Gorkhover, T., Maia, F. R. N. C., “Considerations for three-dimensional image reconstruction from experimental data in coherent diffractive imaging”, IUCrJ 5, 531--541, (2018). DOI:10.1107/S2052252518010047
[59] Zavaraki, A. J., Huang, J., Ji, Y., Ågren, H., “Low toxic Cu2GeS3/InP quantum dot sensitized infrared solar cells”, Journal of Renewable and Sustainable Energy 10, , (2018). DOI:10.1063/1.5044608
[60] Phuyal, D., Safdari, M., Pazoki, M., Liu, P., Philippe, B., Kvashnina, K. O., Karis, O., Butorin, S., Rensmo, H., Edvinsson, T., Kloo, L., Gardner, J., “Electronic Structure of Two-Dimensional Lead(II) Iodide Perovskites: An Experimental and Theoretical Study”, Chemistry of Materials 30, 4959--4967, (2018). DOI:10.1021/acs.chemmater.8b00909
[61] Karaush, N. N., Baryshnikov, G. V., Ågren, H., Minaev, B. F., “A theoretical study of new representatives of closed- and open-circle benzofuran and benzocyclopentadienone oligomers”, New Journal of Chemistry 42, 11493--11505, (2018). DOI:10.1039/C8NJ00601F
[62] Murugan, N. A., Nordberg, A., Ågren, H., “Different Positron Emission Tomography Tau Tracers Bind to Multiple Binding Sites on the Tau Fibril: Insight from Computational Modeling”, ACS Chemical Neuroscience 9, 1757--1767, (2018). DOI:10.1021/acschemneuro.8b00093
[63] Mårtensson, N., Eriksson, M., “The saga of MAX IV, the first multi-bend achromat synchrotron light source”, Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment 907, 97--104, (2018). DOI:10.1016/j.nima.2018.03.018
[64] Karaush, N. N., Minaeva, V. A., Baryshnikov, G. V., Minaev, B. F., Ågren, H., “Identification of tautomeric intermediates of a novel thiazolylazonaphthol dye – A density functional theory study”, Spectrochimica Acta Part A  Molecular and Biomolecular Spectroscopy 203, 324--332, (2018). DOI:10.1016/j.saa.2018.05.096
[65] Ozer, L. Y., Apostoleris, H., Ravaux, F., Shylin, S. I., Mamedov, F., Lindblad, A., Johansson, F., Chiesa, M., Sá, J., Palmisano, G., “Long-Lasting Non-hydrogenated Dark Titanium Dioxide: Medium Vacuum Anneal for Enhanced Visible Activity of Modified Multiphase Photocatalysts”, ChemCatChem 10, 2949--2954, (2018). DOI:10.1002/cctc.201800097
[66] Koulentianos, D., Sorbonne Univ, C., Carniato, S., Püttner, R., Goldsztejn, G., Marchenko, T., Synchrotron SOLEIL, B. 4., Travnikova, O., Synchrotron SOLEIL, B. 4., Journel, L., Synchrotron SOLEIL, B. 4., Guillemin, R., Synchrotron SOLEIL, B. 4., Céolin, D., Rocco, M. L. M., Piancastelli, M. N., Feifel, R., Simon, M., Synchrotron SOLEIL, B. 4., “Double-core-hole states in CH3CN: Pre-edge structures and chemical-shift contributions”, Journal of Chemical Physics 149, , (2018). DOI:10.1063/1.5047854
[67] Kuklin, A. V., Baryshnikov, G. V., Minaev, B. F., Ignatova, N., Ågren, H., “Strong Topological States and High Charge Carrier Mobility in Tetraoxa[8]circulene Nanosheets”, The Journal of Physical Chemistry C 122, 22216--22222, (2018). DOI:10.1021/acs.jpcc.8b08596
[68] Lanzilotto, V., Silva, J. L., Zhang, T., Stredansky, M., CNR, I., Grazioli, C., Simonov, K., Giangrisostomi, E., Ovsyannikov, R., De Simone, M., Coreno, M., Araujo, C. M., Brena, B., Puglia, C., “Spectroscopic Fingerprints of Intermolecular H-Bonding Interactions in Carbon Nitride Model Compounds”, Chemistry – A European Journal 24, 14198--14206, (2018). DOI:10.1002/chem.201802435
[69] Palacios-Rivera, R., Barrena, E., Faraudo, J., Gargiani, P., Angel Nino, M., Arvanitis, D., Kowalik, I., Jose de Miguel, J., Univ Autonoma Madrid, I. F. M. N. C., Ocal, C., “Enantiopure Supramolecular Motifs of Self-Assembled Diamine-Based Chiral Molecules on Cu(100)”, The Journal of Physical Chemistry C 122, 24129--24136, (2018). DOI:10.1021/acs.jpcc.8b07322
[70] Penfold, T., Szlachetko, J., Gawelda, W., Santomauro, F., Britz, A., van Driel, T., Sala, L., Ebner, S., Southworth, S., Doumy, G., March, A. M., Lehmann, S., Katayama, T., Mucke, M., Iablonskyi, D., Kumagai, Y., Knopp, G., Motomura, K., Togashi, T., Owada, S., Yabashi, M., Rittmann, J., Nielsen, M., Pajek, M., Ueda, K., Chergui, M., Abela, R., Milne, C., “Revealing hole trapping in zinc oxide nanoparticles by time-resolved X-ray spectroscopy”, Abstract of Papers of the American Chemical Society 256, , (2018). DOI:
[71] Ghahremanpour, M. M., van Maaren, P. J., Caleman, C., Hutchison, G. R., Van der Spoel, D., “Polarizable Drude Model with s-Type Gaussian or Slater Charge Density for General Molecular Mechanics Force Fields”, Journal of Chemical Theory and Computation 14, 5553--5566, (2018). DOI:10.1021/acs.jctc.8b00430
[72] Zhou, Y., Baryshnikov, G., Bogdan Khmelnitsky Natl Univ, D. C. &. N. S., Li, X., Zhu, M., Ågren, H., Zhu, L., “Anti-Kasha's Rule Emissive Switching Induced by Intermolecular H-Bonding”, Chemistry of Materials 30, 8008--8016, (2018). DOI:10.1021/acs.chemmater.8b03699
[73] Jalebi, M. A., Andaji-Garmaroudi, P., Pearson, A. J., Divitini, G., Cacovich, S., Inst Photovolta IledeFrance IPVF 30, R. D. 1., Philippe, B., Rensmo, H., Ducati, C., Friend, R. H., Stranks, S. D., “Potassium- and Rubidium-Passivated Alloyed Perovskite Films: Optoelectronic Properties and Moisture Stability”, ACS ENERGY LETTERS 3, 2671--2678, (2018). DOI:10.1021/acsenergylett.8b01504
[74] Richter, C., Hollas, D., Saak, C., Förstel, M., Tech Univ Berlin, I. O. &. A. P., Miteva, T., Mucke, M., Björneholm, O., Sisourat, N., Slavicek, P., Hergenhahn, U., Max Planck Inst Plasma Phys, W. 1., “Competition between proton transfer and intermolecular Coulombic decay in water”, Nature Communications 9, , (2018). DOI:10.1038/s41467-018-07501-6
[75] Ekholm, V., Caleman, C., Bjärnhall Prytz, N., Walz, M., Werner, J., Öhrwall, G., Rubensson, J., Björneholm, O., “Strong Enrichment of Atmospherically Relevant Organic Ions at the Aqueous Interface: The Role of Ion Pairing and Cooperative Effects”, Physical Chemistry, Chemical Physics  PCCP 20, 27185--27191, (2018). DOI:10.1039/c8cp04525a
[76] Marchenko, T., Synchrotron SOLEIL, O. M., Inhester, L., Hamburg Ctr Ultrafast Imaging, L. C. 1., Goldsztejn, G., Travnikova, O., Synchrotron SOLEIL, O. M., Journel, L., Synchrotron SOLEIL, O. M., Guillemin, R., Synchrotron SOLEIL, O. M., Ismail, I., Koulentianos, D., Univ Gothenburg, D. P., Céolin, D., Püttner, R., Piancastelli, M. N., Simon, M., Synchrotron SOLEIL, O. M., “Ultrafast nuclear dynamics in the doubly-core-ionized water molecule observed via Auger spectroscopy”, Physical Review A: covering atomic, molecular, and optical physics and quantum information 98, , (2018). DOI:10.1103/PhysRevA.98.063403
[77] Saki, Z., Aitola, K., Sveinbjörnsson, K., Yang, W., Svanström, S., Cappel, U. B., Rensmo, H., Johansson, E., Taghavinia, N., Sharif Univ Technol, I. N. &. N., Boschloo, G., “The synergistic effect of dimethyl sulfoxide vapor treatment and C-60 electron transporting layer towards enhancing current collection in mixed-ion inverted perovskite solar cells”, Journal of Power Sources 405, 70--79, (2018). DOI:10.1016/j.jpowsour.2018.09.100
[78] Mudedla, S. K., Murugan, N. A., Ågren, H., “Free Energy Landscape for Alpha-Helix to Beta-Sheet Interconversion in Small Amyloid Forming Peptide under Nanoconfinement”, The Journal of Physical Chemistry B 122, 9654--9664, (2018). DOI:10.1021/acs.jpcb.8b07917
[79] Allum, F., Burt, M., Amini, K., Boll, R., Köckert, H., Olshin, P. K., Bari, S., Bomme, C., Brauße, F., de Miranda, B. C., Düsterer, S., Erk, B., Géléoc, M., Geneaux, R., Gentleman, A. S., Goldsztejn, G., Guillemin, R., Holland, D. M. P., Ismail, I., Johnsson, P., Journel, L., Küpper, J., Univ Hamburg, C. U. I., Univ Hamburg, D. P., Univ Hamburg, D. C., Lahl, J., Lee, J. W. L., Maclot, S., Mackenzie, S. R., Manschwetus, B., Mereshchenko, A. S., Mason, R., Palaudoux, J., Piancastelli, M. N., Penent, F., Rompotis, D., European XFEL, H. 4., Rouzée, A., Ruchon, T., Rudenko, A., Savelyev, E., Simon, M., Schirmel, N., Stapelfeldt, H., Techert, S., Max Planck Inst Biophys Chem, D. G., Univ Gottingen, I. X. P., Travnikova, O., Trippel, S., Univ Hamburg, C. U. I., Underwood, J. G., Vallance, C., Wiese, J., Univ Hamburg, D. C., Ziaee, F., Brouard, M., Marchenko, T., Rolles, D., “Coulomb explosion imaging of CH3I and CH2CII photodissociation dynamics”, Journal of Chemical Physics 149, , (2018). DOI:10.1063/1.5041381
[80] Gusev, A. N., Shul'gin, V. F., Braga, E. V., Nemec, I., Minaev, B. F., Baryshnikov, G. V., Travnicek, Z., Ågren, H., Eremenko, I. L., Lyssenko, K. A., Linert, W., “Synthesis and photophysical properties of Zn(II) Schiff base complexes possessing strong solvent-dependent solid-state fluorescence”, Polyhedron 155, 202--208, (2018). DOI:10.1016/j.poly.2018.08.019
[81] Tchaplyguine, M., Zhang, C., Andersson, T., Björneholm, O., “Ag-Cu oxide nanoparticles with high oxidation states: towards new high Tc materials”, Dalton Transactions 47, 16660--16667, (2018). DOI:10.1039/c8dt04118k
[82] Pietrini, A., Bielecki, J., Timneanu, N., Hantke, M. F., Andreasson, J., Loh, N. D., Larsson, D. S. D., Boutet, S., Hajdu, J., Maia, F. R. N. C., Nettelblad, C., “A statistical approach to detect protein complexes at X-ray free electron laser facilities”, Communications Physics 1, 92:1--11, (2018). DOI:10.1038/s42005-018-0092-6
[83] Werner, J., Persson, I., Björneholm, O., Kawecki, D., Saak, C., Walz, M., Ekholm, V., Unger, I., Valtl, C., Caleman, C., Öhrwall, G., Prisle, N. L., Univ Helsinki, D. A. S., “Shifted Equilibria of Organic Acids and Bases in the Aqueous Surface Region”, Physical Chemistry, Chemical Physics  PCCP 20, 23281--23293, (2018). DOI:10.1039/c8cp01898g
[84] Toffoli, D., Guarnaccio, A., Grazioli, C., Zhang, T., Johansson, F., de Simone, M., Coreno, M., Santagata, A., D’Auria, M., Puglia, C., Bernes, E., Stener, M., Fronzoni, G., “Electronic Structure Characterization of a Thiophene Benzo-Annulated Series of Common Building Blocks for Donor and Acceptor Compounds Studied by Gas Phase Photoelectron and Photoabsorption Synchrotron Spectroscopies”, Journal of Physical Chemistry A 122, 8745--8761, (2018). DOI:10.1021/acs.jpca.8b08333
[85] Phuyal, D., Mukherjee, S., Das, S., Jana, S., Kvashnina, K. O., Helmholtz Zentrum Dresden-Rossendorf (HZDR), I. o. R. E. -. P. B. 5., Sarma, D. D. , Rensmo, H., Butorin, S. M., Karis, O., “The origin of low bandgap and ferroelectricity of a co-doped BaTiO3”, Europhysics letters 124, , (2018). DOI:10.1209/0295-5075/124/27005
[86] Svanström, S., Jacobsson, J., Sloboda, T., Giangrisostomi, E., Ovsyannikov, R., Rensmo, H., Cappel, U., “Effect of halide ratio and Cs+ addition on the photochemical stability of lead halide perovskites”, Journal of Materials Chemistry A 6, 22134--22144, (2018). DOI:10.1039/C8TA05795H
[87] Jacobsson, J., Svanström, S., Andrei, V., Rivett, J. P. H., Kornienko, N., Philippe, B., Cappel, U. B., Rensmo, H., Deschler, F., Boschloo, G., “Extending the Compositional Space of Mixed Lead Halide Perovskites by Cs, Rb, K, and Na Doping”, The Journal of Physical Chemistry C 122, 13548--13557, (2018). DOI:10.1021/acs.jpcc.7b12464
[88] Abdi-Jalebi, M., Pazoki, M., Philippe, B., Dar, M. I., Alsari, M., Sadhanala, A., Divitini, G., Imani, R., Lilliu, S., UAE Ctr Crystallog, D., Kullgren, J., Rensmo, H., Gratzel, M., Friend, R. H., “Dedoping of Lead Halide Perovskites Incorporating Monovalent Cations”, ACS Nano 12, 7301--7311, (2018). DOI:10.1021/acsnano.8b03586
[89] Phuyal, D., Jain, S. M., Philippe, B., Johansson, M. B., Pazoki, M., Kullgren, J., Kvashnina, K. O., HZDR, I. R. E., Klintenberg, M., Johansson, E., Butorin, S., Karis, O., Rensmo, H., “The electronic structure and band interface of cesium bismuth iodide on a titania heterostructure using hard X-ray spectroscopy”, Journal of Materials Chemistry A 6, 9498--9505, (2018). DOI:10.1039/c8ta00947c
[90] Luque, F. J., Nino, M. A., Spilsbury, M. J., Kowalik, I. A., Arvanitis, D., de Miguel, J. J., Univ Autonoma Madrid, I. M. S. N. C., Univ Autonoma Madrid, I. C. M. P. I., “Enantiosensitive Bonding of Chiral Molecules on a Magnetic Substrate Investigated by Means of Electron Spectroscopies”, Chimia (Basel) 72, 418--423, (2018). DOI:10.2533/chimia.2018.418