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Electronic coupling between the unoccupied states of the organic and inorganic sublattices of methylammonium lead iodide: A hybrid organic-inorganic perovskite single crystal

Gabriel J. Man1,*, Cody M. Sterling2, Chinnathambi Kamal2,3, Konstantin A. Simonov1,†, Sebastian Svanström1, Joydev Acharya4, Fredrik O. L. Johansson1, Erika Giangrisostomi5, Ruslan Ovsyannikov5 et al.

Thomas Huthwelker6, Sergei M. Butorin1, Pabitra K. Nayak4,‡, Michael Odelius2, and Håkan Rensmo1,§

  • 1Condensed Matter Physics of Energy Materials, Division of X-ray Photon Science, Department of Physics and Astronomy, Uppsala University, Box 516, Uppsala 75121, Sweden
  • 2Department of Physics, Stockholm University, AlbaNova University Center, Stockholm 10691, Sweden
  • 3Theory and Simulations Laboratory, HRDS, Raja Ramanna Centre for Advanced Technology, Indore 452013, India
  • 4TIFR Centre for Interdisciplinary Sciences, Tata Institute of Fundamental Research, 36/P, Gopanpally Village, Serilingampally Mandal, Hyderabad 500046, India
  • 5Institute Methods and Instrumentation for Synchrotron Radiation Research, Helmholtz-Zentrum Berlin GmbH, Albert-Einstein-Straße 15, Berlin 12489, Germany
  • 6Paul Scherrer Institut, WLGA/212, Forschungsstrasse 111, 5232 Villigen, Switzerland

  • *gman@alumni.princeton.edu
  • †Present address: Swerim AB, Kista, Stockholm, 16407, Sweden.
  • ‡pabitra.nayak@tifrh.res.in
  • §hakan.rensmo@physics.uu.se

Antimony Bromide Organic–Inorganic Hybrid Compound with a Long-Chain Diamine Showing Switchable Phase Transition and Second-Harmonic Generation Properties

Ziqin Peng, Pan Wang, Zhenhong Wei, Wenjing Guo, Haina Zhang, and Hu Cai

Inorg. Chem. 63 184 (2024)

Band Gaps of Hybrid Metal Halide Perovskites: Efficient Estimation

Sergei M. Butorin

ACS Appl. Energy Mater. 7 7285 (2024)

Electronic structures and molecular dynamics of gadolinium-doped FAPbI3 perovskite crystals

Atsushi Suzuki and Takeo Oku

Jpn. J. Appl. Phys. 62 SK1006 (2023)

Metal halide perovskite layers studied by scanning transmission X-ray microscopy

Chloé Dindault, Haeyeon Jun, Denis Tondelier, Bernard Geffroy, Jean-Eric Bourée, Yvan Bonnassieux, Philip Schulz, and Sufal Swaraj

RSC Adv. 12 25570 (2022)

A-site cation influence on the conduction band of lead bromide perovskites

Gabriel J. Man, Chinnathambi Kamal, Aleksandr Kalinko, Dibya Phuyal, Joydev Acharya, Soham Mukherjee, Pabitra K. Nayak, Håkan Rensmo, Michael Odelius, and Sergei M. Butorin

Nat Commun 13 3839 (2022)

Electronic Structure and Chemical Bonding in Methylammonium Lead Triiodide and Its Precursor Methylammonium Iodide

Cody M. Sterling, Chinnathambi Kamal, Alberto García-Fernández, Gabriel J. Man, Sebastian Svanström, Pabitra K. Nayak, Sergei M. Butorin, Håkan Rensmo, Ute B. Cappel, and Michael Odelius

J. Phys. Chem. C 126 20143 (2022)

Resonant X-ray photoelectron spectroscopy: identification of atomic contributions to valence states

J. M. Seymour, E. Gousseva, R. A. Bennett, A. I. Large, G. Held, D. Hein, G. Wartner, W. Quevedo, R. Seidel, C. Kolbeck, C. J. Clarke, R. M. Fogarty, R. A. Bourne, R. G. Palgrave, P. A. Hunt, and K. R. J. Lovelock

Faraday Discuss. 236 389 (2022)

Spatial microheterogeneity in the valence band of mixed halide hybrid perovskite materials

Axel Erbing, Bertrand Philippe, Byung-wook Park, Ute B. Cappel, Håkan Rensmo, and Michael Odelius

Chem. Sci. 13 9285 (2022)

A versatile spin- and angle-resolved inverse photoemission setup : application to Rashba effect

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