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Recent advances in colloidal synthesis methods have led to increased research focus on halide perovskites. Due to highly ionic crystal structure of perovskite materials, stability issue pops up especially against polar solvents such as…

Materials Science · Physics 2018-03-08 Baris Akbali , Gokhan Topcu , Tugrul Guner , Mehmet Ozcan , Mustafa Muammer Demir , Hasan Sahin

The recent reaching of 20% of conversion efficiency by solar cells based on metal hybrid perovskites (MHP), e.g., the methylammonium (MA) lead iodide, CH3NH3PbI3 (MAPbI3), has excited the scientific community devoted to the photovoltaics…

Chemical Physics · Physics 2018-12-14 Diego Guedes-Sobrinho , Ivan Guilhon , Marcelo Marques , Lara K. Teles

Photo-induced phase-segregation in mixed halide perovskite MAPb(BrxI1-x)3 is investigated in the full compositional range by correlative X-ray diffraction and photo-luminescence experiments.

Strong deviations in the finite temperature atomic structure of halide perovskites from their average geometry can have profound impacts on optoelectronic and other device-relevant properties. Detailed mechanistic understandings of these…

Materials Science · Physics 2022-02-21 Xiangzhou Zhu , Sebastián Caicedo-Dávila , Christian Gehrmann , David A. Egger

In the development of highly efficient photovoltaic cells, solid perovskite systems have demonstrated unprecedented promise, with the figure of merit exceeding nineteen percent of efficiency. In this paper, we investigate the optical and…

Materials Science · Physics 2015-02-05 Towfiq Ahmed , C. La-O-Vorakiat , T. Salim , Y. M. Lam , Elbert E. M. Chia , Jian-Xin Zhu

We investigate the variation of the band gap across the Ruddlesden-Popper (RP) series (An+1BnX3n+1) in model chalcogenide, oxide, and halide materials to understand the factors influencing band gap evolution. In contrast to the oxides and…

Materials Science · Physics 2019-10-30 Wei Li , Shanyuan Niu , Boyang Zhao , Ralf Haiges , Jayakanth Ravichandran , Anderson Janotti

Metal halide perovskites have emerged as an exciting class of materials for applications in solar energy harvesting, optical devices, catalysis, and other photophysical applications. Many of the exciting properties of halide perovskites are…

Materials Science · Physics 2024-04-18 Colin M. Hylton-Farrington , Richard C. Remsing

Perovskite oxides ABO$_3$ containing heavy B-site elements are a class of candidate materials to host topological metals with a large spin-orbit interaction. In contrast to the band insulator BaSnO$_3$, the semimetal BaPbO$_3$ is proposed…

Cross-sectional scanning tunnelling microscopy and spectroscopy (XSTM/S) were used to map out the band alignment across the complex oxide interface of La$_{2/3}$Ca$_{1/3}$MnO$_{3}$/Nb-doped SrTiO$_{3}$. By a controlled cross-sectional…

Mesoscale and Nanoscale Physics · Physics 2010-07-06 TeYu Chien , Jian Liu , Jacques Chakhalian , Nathan P. Guisinger , John W. Freeland

Hysteresis in the current-voltage characteristics of hybrid organic-inorganic perovskite-based solar cells is one of the fundamental aspects of these cells that we do not understand well. One possible cause, suggested for the hysteresis, is…

Solar cells based on a light absorbing layer of the organometal halide perovskite CH$_3$NH$_3$PbI$_3$ have recently reached 15% conversion efficiency, though how these materials work remains largely unknown. We analyse the electronic…

Materials Science · Physics 2014-04-24 Federico Brivio , Keith T. Butler , Aron Walsh , Mark van Schilfgaarde

In the rapidly progressing field of organometal halide perovskites, the dimensional reduction could open up new opportunities for device applications. Herein, taking the recently synthesized trimethylsulfonium lead triiodide…

Mesoscale and Nanoscale Physics · Physics 2020-06-08 Muhammad Ejaz Khan , Juho Lee , Seongjae Byeon , Yong-Hoon Kim

By angle-resolved photoemission spectroscopy and polarization-dependent infrared reflectivity measurements the electronic and vibrational properties of low-dimensional perovskites Sr$_{1-y}$La$_y$NbO$_{3.5-x}$ were studied along different…

Materials Science · Physics 2009-11-10 C. A. Kuntscher , S. Schuppler , P. Haas , B. Gorshunov , M. Dressel , M. Grioni , F. Lichtenberg

Hybrid organic-inorganic halide perovskites have emerged as a disruptive new class of materials, exhibiting optimum properties for a broad range of optoelectronic applications, most notably for photovoltaics. The first report of highly…

Materials Science · Physics 2018-08-21 Marina R. Filip , George Volonakis , Feliciano Giustino

Single crystalline bismuth (Bi) is known to have a peculiar electronic structure which is very close to the topological phase transition. The modification of the surface states of Bi depending on the temperature are revealed by…

Materials Science · Physics 2019-04-17 Y. Ohtsubo , Y. Yamashita , J. Kishi , S. Ideta , K. Tanaka , H. Yamane , J. E. Rault , P. Le Fèvre , F. Bertran , S. Kimura

In this work, the structural, optical, and electronic properties of rare-earth perovskites of the general formula RCrO3, where R represents the rare-earth Gd, Tb, Dy, Ho, Er, and Tm, have been studied in detail. These compounds were…

Materials Science · Physics 2022-04-27 Jianhang Shi , Gayanath W. Fernando , Yanliu Dang , Steven L. Suib , Menka Jain

Perovskite chalcogenides are gaining substantial interest as an emerging class of semiconductors for optoelectronic applications. High quality samples are of vital importance to examine their inherent physical properties. We report the…

Single layer Pb on top of (111) surfaces of group IV semiconductors hosts charge density wave and superconductivity depending on the coverage and on the substrate. These systems are normally considered to be experimental realizations of…

Strongly Correlated Electrons · Physics 2021-07-16 Cesare Tresca , Matteo Calandra

We consider the Br vacancy in CsPbBr3 as a prototype for the impact of structural dynamics on defect energetics in halide perovskites (HaPs). Using first-principles molecular dynamics based on density functional theory, we find that the…

Materials Science · Physics 2019-07-01 Ayala V. Cohen , David A. Egger , Andrew M. Rappe , Leeor Kronik

Layered ruthenates are prototype materials with strong structure-property correlations. We report the structural and physical properties of double-layered perovskite Sr3(Ru1-xMnx)2O7 single crystals with 0<=x<=0.7. Single crystal x-ray…

Strongly Correlated Electrons · Physics 2012-05-01 Biao Hu , Gregory T. McCandless , V. O. Garlea , S. Stadler , Yimin Xiong , Julia Y. Chan , E. W. Plummer , R. Jin