Investigation of the photovoltaic properties of BaHf1-xZrxS3 (x1) chalcogenide perovskites using first principles calculations

Materials Today Energy - Tập 20 - Trang 100689 - 2021
R. Chami1, A. Lekdadri2, L.H. Omari2, E.K. Hlil3, M. Chafi1
1LEPE, High School of Technology, University Hassan II, of Casablanca, B.P 5366 Maarif, Morocco
2LPMMAT, Faculty of Sciences Ain Chock, University Hassan II, of Casablanca, B.P 5366 Maarif, Morocco
3Univ. Grenoble Alpes, CNRS, Grenoble INP, Institut Néel, 38000 Grenoble, France

Tài liệu tham khảo

Kojima, 2009, J. Am. Chem. Soc., 131, 6050, 10.1021/ja809598r Im, 2011, Nanoscale, 3, 4088, 10.1039/c1nr10867k Kim, 2012, Sci. Rep., 2, 591, 10.1038/srep00591 Burschka, 2013, Nature, 499, 316, 10.1038/nature12340 Liu, 2013, Nature, 501, 395, 10.1038/nature12509 Liu, 2013, Nat. Photon., 8, 133, 10.1038/nphoton.2013.342 Luo, 2020, Nat. Rev. Mater., 5, 44, 10.1038/s41578-019-0151-y Zhou, 2014, Science, 345, 542, 10.1126/science.1254050 Best Research-Cell Efficiency Chart https://www.nrel.gov/pv/cell-efficiency.html (NREL, accessed 16 October 2020). Repins, 2008, Prog. Photovoltaics Res. Appl., 16, 235, 10.1002/pip.822 Xiao, 2017, Mater. Horiz., 4, 206, 10.1039/C6MH00519E Xiao, 2017, Adv. Energy Mater., 7, 1701136, 10.1002/aenm.201701136 Sun, 2015, Nano Lett., 15, 581, 10.1021/nl504046x Lelieveld, 1980, Acta Crystallogr. Sect. B Struct. Crystallogr. Cryst. Chem., 36, 2223, 10.1107/S056774088000845X Meng, 2016, Chem. Mater., 28, 821, 10.1021/acs.chemmater.5b04213 Li, 2018, Eur. Phys. J. B, 91, 188, 10.1140/epjb/e2018-90125-6 Nishigaki, 2020, Sol. RRL, 4, 1900555, 10.1002/solr.201900555 Perera, 2016, Nanomater. Energy, 22, 129, 10.1016/j.nanoen.2016.02.020 Niu, 2017, Adv. Mater., 29, 16, 10.1002/adma.201604733 Kato, 2019, Phys. Rev. Applied., 12 Werner, 2018, Adv. Mater. Interfaces., 5, 1700731, 10.1002/admi.201700731 White, 2006 Blaha, 2014 Perdew, 1997, Phys. Rev. Lett., 78, 1396, 10.1103/PhysRevLett.78.1396 Tran, 2009, Phys. Rev. Lett., 102, 26401, 10.1103/PhysRevLett.102.026401 Becke, 2006, J. Chem. Phys., 124, 221101, 10.1063/1.2213970 Becke, 1989, Phys. Rev., 39, 3761, 10.1103/PhysRevA.39.3761 Delin, 1996, Phys. Rev. B, 54, 1673, 10.1103/PhysRevB.54.1673 Yu, 1999 Yu, 2012, Phys. Rev. Lett., 108 Shockley, 1961, J. Appl. Phys., 32, 510, 10.1063/1.1736034 2019 Wang, 2016, Nanomater. Energy, 22, 507, 10.1016/j.nanoen.2016.02.036 Bercx, 2016, Phys. Chem. Chem. Phys., 18, 20542, 10.1039/C6CP03468C Fang, 2018, Energy Mater. Sol. Cells, 188, 93, 10.1016/j.solmat.2018.08.015 Latimer, 2018, NPJ Comput. Mater., 4, 40, 10.1038/s41524-018-0091-x Gross, 2017, Phys. Rev. Appl., 8, 10.1103/PhysRevApplied.8.044014 Goldschmidt, 1926, Die. Naturwissenschaften, vol. 14, 477, 10.1007/BF01507527 Shannon, 1976, Acta Crystallogr. A., 32, 751, 10.1107/S0567739476001551 Yoshitsune, 2019, Phys. Rev. Appl., 12 Sha, 2015, Appl. Phys. Lett., 106, 221104, 10.1063/1.4922150 Madsen, 2006, Comput. Phys. Commun., 175, 67, 10.1016/j.cpc.2006.03.007