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Photophysical Ion Dynamics in Hybrid Perovskite MAPbX3 (X=Br, Cl) Single Crystals
Chalmers Univ Technol, Dept Phys, SE-41296 Gothenburg, Sweden..
Uppsala University, Disciplinary Domain of Science and Technology, Physics, Department of Physics and Astronomy, Materials Theory. Univ Zurich, Phys Inst, Winterthurerstr 190, CH-8057 Zurich, Switzerland.ORCID iD: 0000-0001-8879-7875
STFC Rutherford Appleton Lab, ISIS Pulsed Neutron & Muon Facil, Didcot OX11 0QX, Oxon, England..
STFC Rutherford Appleton Lab, ISIS Pulsed Neutron & Muon Facil, Didcot OX11 0QX, Oxon, England..
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2024 (English)In: ADVANCED PHYSICS RESEARCH, ISSN 2751-1200, Vol. 3, no 3, article id 2300120Article in journal (Refereed) Published
Abstract [en]

Hybrid organic-inorganic perovskites (HOIPs) are promising candidates for next-generation photovoltaic materials. However, there is a debate regarding the impact of interactions between the organic center and the surrounding inorganic cage on the solar cell's high diffusion lengths. It remains unclear whether the diffusion mechanism is consistent across various halide perovskite families and how light illumination affects carrier lifetimes. The focus is on ion kinetics of (CH3NH3)PbX3 (X = Br, Cl) perovskite halide single crystals. Muon spectroscopy (mu+SR)is employed to investigate the fluctuations and diffusion of ions via the relaxation of muon spins in local nuclear field environments. Within a temperature range of 30-340 K, ion kinetics are studied with and without white-light illumination. The results show a temperature shift of the tetragonal-orthorhombic phase transition on the illuminated samples, as an effect of increased organic molecule fluctuations. This relation is supported by density functional theory (DFT) calculations along the reduction of the nuclear field distribution width between the phase transitions. The analysis shows that, depending on the halide ion, the motional narrowing from H and N nuclear moments represents the molecular fluctuations. The results demonstrate the importance of the halide ion and the effect of illumination on the compound's structural stability and electronic properties.

Place, publisher, year, edition, pages
John Wiley & Sons, 2024. Vol. 3, no 3, article id 2300120
Keywords [en]
ion dynamics, organic-inorganic hybrid perovskite, muon spin spectroscopy, structural stability
National Category
Atom and Molecular Physics and Optics Condensed Matter Physics
Identifiers
URN: urn:nbn:se:uu:diva-537003DOI: 10.1002/apxr.202300120ISI: 001283295400008OAI: oai:DiVA.org:uu-537003DiVA, id: diva2:1893513
Funder
Swedish Research Council, 2014-6426Swedish Research Council, 2016-06955Swedish Research Council, 2022-06217Swedish Research Council, 2017-05078Knut and Alice Wallenberg Foundation, 2021.0150Swedish Foundation for Strategic Research, SNP21-0004Available from: 2024-08-29 Created: 2024-08-29 Last updated: 2024-08-29Bibliographically approved

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