Optical and Electronic Anisotropies in Perovskitoid Crystals of Cs3Bi2I9 Studies of Nuclear Radiation Detection

Sun, Qihao; Xu, Yadong; Zhang, Hongjian; Xiao, Bao; Liu, Xin; Dong, Jiangpeng; Cheng, Yuanbo; Zhang, Binbin; Jie, Wanqi; Kanatzidis, Mercouri G.

doi:10.1039/c8ta09525f

Title: Optical and Electronic Anisotropies in Perovskitoid Crystals of Cs₃Bi₂I₉ Studies of Nuclear Radiation Detection

Journal Article · Thu Oct 25 00:00:00 EDT 2018 · Journal of Materials Chemistry. A

DOI:https://doi.org/10.1039/c8ta09525f· OSTI ID:1490335

^[1];

^[2];

^[3]; Xiao, Bao ^[3]; Liu, Xin ^[3]; Dong, Jiangpeng ^[3]; Cheng, Yuanbo ^[3]; Zhang, Binbin ^[1]; Jie, Wanqi ^[1];

^[4]

State Key Laboratory of Solidification Processing, Xi'an (China); Northwestern Polytechnical Univ., Xi'an (China)
State Key Laboratory of Solidification Processing, Xi'an (China); Northwestern Polytechnical Univ., Xi'an (China); Northwestern Univ., Evanston, IL (United States)
Northwestern Polytechnical Univ., Xi'an (China)
Northwestern Univ., Evanston, IL (United States); Argonne National Lab. (ANL), Argonne, IL (United States)

The halide perovskitoid compound Cs₃Bi₂I₉ (CBI) has attracted considerable interest as a semiconductor because of its outstanding stability and reduced toxicity compared with lead-based halide perovskites. Here, we report the growth of nuclear radiation detection grade CBI bulk crystals (Φ 15 × 60 mm³) with a high resistivity of over 10¹⁰ Ω cm using a modified vertical Bridgman method. Because of their layered crystal structures we investigated the anisotropy in the optical and electrical properties using different crystal orientations. The CBI₍₀₀₁₎ sample exhibits a resistivity of ~10¹² Ω cm compared to ~10¹⁰ Ω cm for the CBI₍₁₀₀₎ sample. This is due to the anisotropic mobility in the two crystallographic directions. Using 425 nm LED (~200 mW cm^–2) illumination CBI₍₀₀₁₎ possesses a superior optical response with a switching ratio of over 40, which is critically higher than that of CBI₍₁₀₀₎ (<2). Detectors of 2 mm thickness show a capability of detecting ²⁴¹Am@5.49 MeV α particles, with good peak discrimination. A full width at half maximum (FWHM) of 32% was obtained under a bias of 560 V. Simultaneously, the electron mobility and mobility lifetime (μτ) were calculated to be 6.10 cm² V^–1 s^–1 and 2.03 × 10^–5 cm V^–1, respectively. First-principles density functional theory calculations confirm the crystallographic anisotropy of the carrier effective masses. Additionally, a significant X-ray sensitivity of 111.9 μC Gy^–1 cm^–2 for a CBI detector was observed, under 80 kVp X-rays at an electrical field of 450 V cm^–1.

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Research Organization:: Argonne National Laboratory (ANL), Argonne, IL (United States)

Sponsoring Organization:: Fundamental Research Funds for the Central Universities; National Natural Science Foundation of China (NSFC); National Key Research and Development Program of China; US Department of Homeland Security (DHS); USDOE

Grant/Contract Number:: AC02-06CH11357

OSTI ID:: 1490335

Journal Information:: Journal of Materials Chemistry. A, Vol. 6, Issue 46; ISSN 2050-7488

Publisher:: Royal Society of ChemistryCopyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 68 works

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References (49)

Centimeter-Sized Inorganic Lead Halide Perovskite CsPbBr ₃ Crystals Grown by an Improved Solution Method Zhang, Hongjian; Liu, Xin; Dong, Jiangpeng Crystal Growth & Design, Vol. 17, Issue 12 https://doi.org/10.1021/acs.cgd.7b01086	journal	October 2017
Caesium enneabromodibismuthate(III) Lazarini, F. Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry, Vol. 33, Issue 9 https://doi.org/10.1107/S0567740877009984	journal	September 1977
The Renaissance of Halide Perovskites and Their Evolution as Emerging Semiconductors Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Accounts of Chemical Research, Vol. 48, Issue 10 https://doi.org/10.1021/acs.accounts.5b00229	journal	September 2015
Bismuth tri-iodide polycrystalline films for X-ray direct and digital imagers Aguiar, I.; Kröger, S.; Fornaro, L. Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment, Vol. 610, Issue 1 https://doi.org/10.1016/j.nima.2009.05.184	journal	October 2009
Investigation of optical anisotropy of refractive-index-profiled porous silicon employing generalized ellipsometry Zangooie, S.; Jansson, R.; Arwin, H. Journal of Materials Research, Vol. 14, Issue 11 https://doi.org/10.1557/JMR.1999.0564	journal	November 1999
Band Gap Engineering of Cs ₃ Bi ₂ I ₉ Perovskites with Trivalent Atoms Using a Dual Metal Cation Hong, Ki-Ha; Kim, Jongseob; Debbichi, Lamjed The Journal of Physical Chemistry C, Vol. 121, Issue 1 https://doi.org/10.1021/acs.jpcc.6b12426	journal	December 2016
Ultrathin Cs ₃ Bi ₂ I ₉ Nanosheets as an Electronic Memory Material for Flexible Memristors Hu, Yanqiang; Zhang, Shufang; Miao, Xiaoliang Advanced Materials Interfaces, Vol. 4, Issue 14 https://doi.org/10.1002/admi.201700131	journal	May 2017
Low-frequency optical phonon modes and carrier mobility in the halide perovskite CH ₃ NH ₃ PbBr ₃ using terahertz time-domain spectroscopy Zhao, Daming; Skelton, Jonathan M.; Hu, Hongwei Applied Physics Letters, Vol. 111, Issue 20 https://doi.org/10.1063/1.4993524	journal	November 2017
Bismuth Based Hybrid Perovskites A ₃ Bi ₂ I ₉ (A: Methylammonium or Cesium) for Solar Cell Application Park, Byung-Wook; Philippe, Bertrand; Zhang, Xiaoliang Advanced Materials, Vol. 27, Issue 43 https://doi.org/10.1002/adma.201501978	journal	September 2015
Dopant compensation in alloyed CH3NH3PbBr3−xClx perovskite single crystals for gamma-ray spectroscopy Wei, Haotong; DeSantis, Dylan; Wei, Wei Nature Materials, Vol. 16, Issue 8 https://doi.org/10.1038/nmat4927	journal	July 2017
Room-temperature compound semiconductor radiation detectors McGregor, D. S.; Hermon, H. Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment, Vol. 395, Issue 1 https://doi.org/10.1016/S0168-9002(97)00620-7	journal	August 1997
Defect Engineering of BiI ₃ Single Crystals: Enhanced Electrical and Radiation Performance for Room Temperature Gamma-Ray Detection Han, HyukSu; Hong, Minki; Gokhale, Sasmit S. The Journal of Physical Chemistry C, Vol. 118, Issue 6 https://doi.org/10.1021/jp411201k	journal	January 2014
Detection of X-ray photons by solution-processed lead halide perovskites Yakunin, Sergii; Sytnyk, Mykhailo; Kriegner, Dominik Nature Photonics, Vol. 9, Issue 7 https://doi.org/10.1038/nphoton.2015.82	journal	May 2015
Compound semiconductor radiation detectors Owens, Alan; Peacock, A. Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment, Vol. 531, Issue 1-2 https://doi.org/10.1016/j.nima.2004.05.071	journal	September 2004
Thallium Chalcohalides for X-ray and γ-ray Detection Johnsen, Simon; Liu, Zhifu; Peters, John A. Journal of the American Chemical Society, Vol. 133, Issue 26 https://doi.org/10.1021/ja202540t	journal	July 2011
Fabrication and testing of antimony doped bismuth tri-iodide semiconductor gamma-ray detectors Gokhale, Sasmit S.; Han, HyukSu; Pelaez, Oswaldo Radiation Measurements, Vol. 91 https://doi.org/10.1016/j.radmeas.2016.04.004	journal	August 2016
Role of Stoichiometry in the Growth of Large Pb ₂ P ₂ Se ₆ Crystals for Nuclear Radiation Detection Xu, Yadong; Fu, Xu; Zheng, Hongjian ACS Photonics, Vol. 5, Issue 2 https://doi.org/10.1021/acsphotonics.7b01119	journal	November 2017
The growth and crystallography of bismuth tri-iodide crystals grown by vapor transport Nason, D.; Keller, Ludwig Journal of Crystal Growth, Vol. 156, Issue 3 https://doi.org/10.1016/0022-0248(95)00291-X	journal	November 1995
Consolidation of the optoelectronic properties of CH3NH3PbBr3 perovskite single crystals Wenger, Bernard; Nayak, Pabitra K.; Wen, Xiaoming Nature Communications, Vol. 8, Issue 1 https://doi.org/10.1038/s41467-017-00567-8	journal	September 2017
α-Particle Detection and Charge Transport Characteristics in the A ₃ M ₂ I ₉ Defect Perovskites (A = Cs, Rb; M = Bi, Sb) McCall, Kyle M.; Liu, Zhifu; Trimarchi, Giancarlo ACS Photonics, Vol. 5, Issue 9 https://doi.org/10.1021/acsphotonics.8b00813	journal	August 2018
Poor Photovoltaic Performance of Cs ₃ Bi ₂ I ₉ : An Insight through First-Principles Calculations Ghosh, Biplab; Chakraborty, Sudip; Wei, Hao The Journal of Physical Chemistry C, Vol. 121, Issue 32 https://doi.org/10.1021/acs.jpcc.7b03501	journal	August 2017
Progress in the Development of CdTe and CdZnTe Semiconductor Radiation Detectors for Astrophysical and Medical Applications Del Sordo, Stefano; Abbene, Leonardo; Caroli, Ezio Sensors, Vol. 9, Issue 5 https://doi.org/10.3390/s90503491	journal	May 2009
Structure–Band Gap Relationships in Hexagonal Polytypes and Low-Dimensional Structures of Hybrid Tin Iodide Perovskites Stoumpos, Constantinos C.; Mao, Lingling; Malliakas, Christos D. Inorganic Chemistry, Vol. 56, Issue 1 https://doi.org/10.1021/acs.inorgchem.6b02764	journal	December 2016
Ion Migration in Organometal Trihalide Perovskite and Its Impact on Photovoltaic Efficiency and Stability Yuan, Yongbo; Huang, Jinsong Accounts of Chemical Research, Vol. 49, Issue 2 https://doi.org/10.1021/acs.accounts.5b00420	journal	January 2016
Growth of bismuth tri-iodide platelets by the physical vapor deposition method Cuña, A.; Noguera, A.; Saucedo, E. Crystal Research and Technology, Vol. 39, Issue 10 https://doi.org/10.1002/crat.200410276	journal	October 2004
Correlation between growth orientation and growth temperature for bismuth tri-iodide films Cuña, A.; Aguiar, I.; Gancharov, A. Crystal Research and Technology, Vol. 39, Issue 10 https://doi.org/10.1002/crat.200410274	journal	October 2004
High-quality bulk hybrid perovskite single crystals within minutes by inverse temperature crystallization Saidaminov, Makhsud I.; Abdelhady, Ahmed L.; Murali, Banavoth Nature Communications, Vol. 6, Article No. 7586 https://doi.org/10.1038/ncomms8586	journal	July 2015
Halide Perovskites: Poor Man's High-Performance Semiconductors Stoumpos, Constantinos C.; Kanatzidis, Mercouri G. Advanced Materials, Vol. 28, Issue 28 https://doi.org/10.1002/adma.201600265	journal	May 2016
Crystal and Electronic Structures of Complex Bismuth Iodides A ₃ Bi ₂ I ₉ ( A = K, Rb, Cs) Related to Perovskite: Aiding the Rational Design of Photovoltaics Lehner, Anna J.; Fabini, Douglas H.; Evans, Hayden A. Chemistry of Materials, Vol. 27, Issue 20 https://doi.org/10.1021/acs.chemmater.5b03147	journal	October 2015
Crystal Growth of the Perovskite Semiconductor CsPbBr ₃ : A New Material for High-Energy Radiation Detection Stoumpos, Constantinos C.; Malliakas, Christos D.; Peters, John A. Crystal Growth & Design, Vol. 13, Issue 7 https://doi.org/10.1021/cg400645t	journal	June 2013
High Defect Tolerance in Lead Halide Perovskite CsPbBr ₃ Kang, Jun; Wang, Lin-Wang The Journal of Physical Chemistry Letters, Vol. 8, Issue 2 https://doi.org/10.1021/acs.jpclett.6b02800	journal	January 2017
Cs ₃ Sb ₂ I ₉ and Cs ₃ Bi ₂ I ₉ with the hexagonal Cs ₃ Cr ₂ Cl ₉ structure type Chabot, B.; Parthé, E. Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry, Vol. 34, Issue 2 https://doi.org/10.1107/S0567740878003684	journal	February 1978
High-throughput electronic band structure calculations: Challenges and tools Setyawan, Wahyu; Curtarolo, Stefano Computational Materials Science, Vol. 49, Issue 2 https://doi.org/10.1016/j.commatsci.2010.05.010	journal	August 2010
Hierarchies of perovskite-like crystals (Review) Aleksandrov, K. S.; Beznosikov, V. V. Physics of the Solid State, Vol. 39, Issue 5 https://doi.org/10.1134/1.1130120	journal	May 1997
Dimensional Reduction: A Design Tool for New Radiation Detection Materials Androulakis, John; Peter, Sebastian C.; Li, Hao Advanced Materials, Vol. 23, Issue 36 https://doi.org/10.1002/adma.201102450	journal	August 2011
Sensitive X-ray detectors made of methylammonium lead tribromide perovskite single crystals Wei, Haotong; Fang, Yanjun; Mulligan, Padhraic Nature Photonics, Vol. 10, Issue 5 https://doi.org/10.1038/nphoton.2016.41	journal	March 2016
Electron–phonon coupling in hybrid lead halide perovskites Wright, Adam D.; Verdi, Carla; Milot, Rebecca L. Nature Communications, Vol. 7, Issue 1 https://doi.org/10.1038/ncomms11755	journal	May 2016
Anisotropy of the refractive index and absorption coefficient in the layer plane of gallium telluride single crystals Sánchez-Royo, J. F.; Segura, A.; Muñoz, V. Physica Status Solidi (a), Vol. 151, Issue 1 https://doi.org/10.1002/pssa.2211510128	journal	September 1995
Semiconducting Tin and Lead Iodide Perovskites with Organic Cations: Phase Transitions, High Mobilities, and Near-Infrared Photoluminescent Properties Stoumpos, Constantinos C.; Malliakas, Christos D.; Kanatzidis, Mercouri G. Inorganic Chemistry, Vol. 52, Issue 15, p. 9019-9038 https://doi.org/10.1021/ic401215x	journal	July 2013
Crystal growth and X-ray structure determination of Rb3Bi2I9 Sidey, V. I.; Voroshilov, Yu. V.; Kun, S. V. Journal of Alloys and Compounds, Vol. 296, Issue 1-2 https://doi.org/10.1016/S0925-8388(99)00481-8	journal	January 2000
Characterization of bismuth tri-iodide single crystals for wide band-gap semiconductor radiation detectors Lintereur, Azaree T.; Qiu, Wei; Nino, Juan C. Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment, Vol. 652, Issue 1 https://doi.org/10.1016/j.nima.2010.12.013	journal	October 2011
The In-Gap Electronic State Spectrum of Methylammonium Lead Iodide Single-Crystal Perovskites Adinolfi, Valerio; Yuan, Mingjian; Comin, Riccardo Advanced Materials, Vol. 28, Issue 17 https://doi.org/10.1002/adma.201505162	journal	March 2016
Strong Electron–Phonon Coupling and Self-Trapped Excitons in the Defect Halide Perovskites A ₃ M ₂ I ₉ (A = Cs, Rb; M = Bi, Sb) McCall, Kyle M.; Stoumpos, Constantinos C.; Kostina, Svetlana S. Chemistry of Materials, Vol. 29, Issue 9 https://doi.org/10.1021/acs.chemmater.7b01184	journal	April 2017
Ferroelectric phase transition in Cs3Bi2I9 Mel’nikova, S. V.; Zaitsev, A. I. Physics of the Solid State, Vol. 39, Issue 10 https://doi.org/10.1134/1.1129882	journal	October 1997
Research into the electrical property variation of undoped CdTe and ZnTe crystals grown under Te-rich conditions Xu, Yadong; Liu, Hang; He, Yihui Journal of Alloys and Compounds, Vol. 612 https://doi.org/10.1016/j.jallcom.2014.05.167	journal	November 2014
Ion Migration in Organometal Trihalide Perovskite and Its Impact on Photovoltaic Efficiency and Stability Jinsong, Huang,; Yongbo, Yuan, American Chemical Society https://doi.org/10.17615/2vnf-mm34	text	January 2016
Dopant compensation in alloyed CH3NH3PbBr3-xClx perovskite single crystals for gamma-ray spectroscopy T. J., Savenije,; J., Huang,; D., Guo, The University of North Carolina at Chapel Hill University Libraries https://doi.org/10.17615/gjzh-1440	text	January 2017
Detection of X-ray photons by solution-processed lead halide perovskites Yakunin, Sergii; Sytnyk, Mykhailo; Kriegner, Dominik ETH Zurich https://doi.org/10.3929/ethz-b-000101479	text	January 2015
High-throughput electronic band structure calculations: challenges and tools Setyawan, Wahyu; Curtarolo, Stefano arXiv https://doi.org/10.48550/arxiv.1004.2974	text	January 2010

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