Abstract
In recent years, the metallic halide perovskite materials without lead have drawn a lot of interest as incredibly fascinating materials for photovoltaic applications. These materials offer exceptional stability, lower toxicity, and convenient process ability making them attractive alternatives to traditional lead-based perovskites. Recent studies have demonstrated its successful utilization in indoor energy applications, thereby suggesting its potential for integration into building-integrated devices. Using the slow evaporation solution growth technique, we have successfully synthesized a non-toxic Cs2ZnCl4 metal halide compound. The X-ray diffraction measurement at room temperature that the Cs2ZnCl4 crystallizes in the orthorhombic phase of the Pnma space group. The morphological characteristics and the ratios of the constituents of Cs2ZnCl4 were determined by the SEM–EDX study. The assignment of the Raman spectrum was based on DFT calculations. The optimized geometries, vibrational frequencies, and Raman intensities were calculated using the CAM-B3LYB technique with the 6-31G(d,p) basis set. Furthermore, the direct band gap of Cs2ZnCl4 was determined to be \(4.04 {\text{eV}}\) based on UV–Visible spectroscopy measurement and DFT calculations. In order to model the electrical response of the grain and the grain boundary, we have chosen an equivalent circuit composed by a series combination of two cells which are composed by a parallel combination of resistance (R) and constant phase element (CPE). The conductivity frequency dependence is interpreted using the non-overlapping small polar tunneling model (NSPT).
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References
Green M, Ho-Baillie A, Snaith H (2014) Nat Photonics 8:506–514
Tan ZK, Moghaddam RS, Lai ML, Docampo P, Higler R, Deschler F, Price M, Sadhanala A, Pazos LM, Credgington D, Hanusch F, Bein T, Snaith HJ, Friend RH (2014) Nat Nanotech 9:687–692
Fang HH, Wang F, Adjokatse S, Zhao N, Even J, Antonietta Loi M (2015) Light Sci Appl 5:e16056–e16056
Stranks SD, Nayak PK, Zhang W, Stergiopoulos T, Snaith HJ (2015) Angew Chem Int Ed 54:3240–3248
Huang H, Zhao F, Liu L, Zhang F, Wu X, Shi L, Zou B, Peiand Q, Zhong H, Appl ACS (2015) Mater Interfaces 7:28128–28133
Wei Y, Xu Y, Wang Q, Wang J, Lu H, Zhu J (2020) Chem Commun 56:5413–5416
Jiang Q, Zhang L, Wang H, Yang X, Meng J, Liu H, Yin Z, Wu J, Zhang X, You J (2016) Nat Energy 2:16177
Jiang Q, Zhao Y, Zhang X, Yang X, Chen Y, Chu Z, Ye Q, Li X, Yin Z, You J (2019) Nat Photonics 13:460–466
Zhang W, Eperon GE, Snaith HJ (2016) Nat Energy 1:16048
Sadhukhan P, Kundu S, Roy A, Ray A, Maji P, Dutta H, Pradhan SK, Das S (2018) Cryst Growth Des 18:3428–3432
Bala A, Deb A, Kumar V (2018) J Phys Chem C 13(122):7464–7473
Maji P, Ray A, Sadhukhan P, Roy A, Das S (2018) Mater Lett 227:268–271
Babayigit A, Duy Thanh D, Ethirajan A, Manca J, Muller M, Boyen HG, Conings B (2016) Sci Rep 6:18721
Eperon GE, Habisreutinger SN, Leijtens T, Bruijnaers BJ, Van Franeker JJ, de Quilettes DW, Pathak S, Sutton RJ, Grancini G, Ginger DS, Janssen RAJ, Petrozza A, Snaith HJ (2015) ACS Nano 9:9380–9393
Babayigit A, Ethirajan A, Muller M, Conings B (2016) Nat Mater 15:247–251
Roknuzzaman M, Ostrikov K, Wang H, Du A, Tesfamichael T (2017) Sci Rep 7:14025
Peedikakkandy L, Bhargava P (2016) RSC Adv 6:19857–19860
Wang A, Guo Y, Muhammad F, Deng Z (2017) Chem Mater 29:6493–6501
Hayatullah, Murtaza G, Muhammad S, Naeem S, Khalid M, Manzar A (2013) Acta Phys Pol, A 124:102–107
Kessentini Y, Ben Ahmed A, Al-Juaid SS, Elaoud Z (2022) J Solid-State Chem 313:123286
Benhaliliba M, Ben Ahmed A, Kaleli M, Meftah SE (2022) Opt Mater 132:112782
Imran M, Khalid M, Jawaria R, Ali A, Asghar MA, Shafiq Z, Assiri MA, Lodhi HM, Carmo Braga AA (2021) ACS Omega 6:33914–33922
Yanai T, Tewand DP, Handy NC (2004) Chem Phys Lett 393:51–57
Frisch MJ, Trucks GW, Schlegel HB, Scuseria GE, Robb MA, Cheeseman JR, Scalmani G, Barone V, Mennucci B and Petersson G (2009) Gaussian 09, Revision D. 01, Gaussian, Inc., Wallingford CT See also: http://www.gaussian.Com
Roy D, Dennington II, Keith Todd A, MillamJohn M. Semichem, Inc, 2000–2016
O’Boyle NM, Tenderholt AL, Langner KM (2008) J Comput Chem 29:839–845
Lim AR, Han OH, Jeong S (2003) J Phys Chem Solids 64:933–937
McGinnety JA (1974) Inorg Chem 13:1057–1061
McGinnety JA (1947) Inorg Chem 13:1057–1061
Dereń PJ, Derouet J, PorcherandD P, Svoronos, (1997) J Mol Struct 404:167–174
Wong PTT (1976) J Chem Phys 64:2186–2191
Avery JS, Burbridge CD, Goodgame DML (1968) Spectrochim Acta, Part A 24:1721–1726
Ben Rhaiem A, Hlel F, Guidara K, Gargouri M (2007) Spectrochimica Acta Part A 66:1107–1109
Quicksall CO, Spiro TG (1966) Inorg Chern 5:2232
Khan SA, Al-Hazmi FS, Al-Heniti S, Faidah AS, Al-Ghamdi AA (2010) Curr Appl Phys 10:145
Lv J, Xu M, Lin S, Shao X, Zhang X, Liu Y, Wang Y, Chen Z, Ma Y (2018) Nano Energy 51:489
Kobayashi N, Kuwae H, Oshima J, Ishimatsu R, Tashiro S, Imato T, Adachi C, Shoji S, Mizuno J (2018) J Lumin 200:19–23
Kalthoum R, Ben Bechir M, Ben Rhaiem A (2020) Physica E 124:114235
Qaid SMH, Al-Asbahi BA, Ghaithan HM, Al Salhi MS, Al Dwayyan S (2020) J Colloid Interface Sci 563:426–434
Fritzsche H and Tauc J (1974). Plenum Press, New York, p 254
Gagandeep SK, Lark BS, Sahota HS (2000) Nucl Sci Eng 134:208–217
Shahane GS, More BM, Rotti CB, Deshmukh LP (1997) Mater Chem Phys 47:263–267
Bhattacharyya D, Chaudhuri S, Pal AK (1992) Vacuum 43:313–316
Kalthoum R, Ben bechir M, Ben Rhaiem A (2020) Physica E Low Dimens Syst Nanostruct 124:114235
Pradhan DK, Misra P, Puli VS, Sahoo S, Pradhan DK, Katiyar RS (2014) J Appl Phys 115:243904
Ray A, Roy A, De S, Chatterjee S, Das S (2018) J Appl Phys 123:104102
Das S, Ghosh A (2017) J Phys Chem B 121:5422
Tealdi C, Chiodelli G, Malavasi L, Flor G, Fisica C, Unita ICNR, Taramelli V, Pavia I (2004) J Mater Chem 14:3553
Wang T, Hu J, Yang H, Jin L, Wei X, Li C, Yan F, Lin Y (2017) J Appl Phys 121:084103
Karoui K, Ben Rhaiem A, Hlel F, Arous M, Guidara K (2012) Mater Chem Phys 133:1
Zuo XZ, Yang J, Yuan B, Song DP, Tang XW, Zhang KJ, Zhu XB, Song WH, Dai JM, Sun YP (2015) J Appl Phys 117:114101
Pattanayak DK, Parida RK, Nayak NC, Panda AB, Parida BN (2018) J Mater Sci Mater Electron 29:6215
Mateyshina Y, Slobodyuk A, Kavun V, Uvarov N (2018) Solid State Ionics 324:196
Dhara A, Sain S, Das S, Pradhan SK (2018) Mater Res Bull 97:169
Ben bechir M, Ben Rhaiem A (2021) J Solid State Chem 296:122021
Ben Bechir M, Dhaou MH (2021) Mater Res Bull 144:111473
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Romdhane, I., Ben Bechir, M., Altarifi, S.M. et al. Vibrational Spectroscopic, Optical Properties and Electrical Conduction Mechanism of Lead-Free Perovskite Cs2ZnCl4. Chemistry Africa 7, 2209–2220 (2024). https://doi.org/10.1007/s42250-023-00869-z
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DOI: https://doi.org/10.1007/s42250-023-00869-z