Physical and chemical aspects of the study of clusters, nanostructures and nanomaterials. Founded at 2009


Effect of defect concentration in perovskite and heterojunctions on photovoltaic characteristics of a solar

A.Z. Agoev1, A.M. Karmokov1, E.N. Kozyrev2, O.A. Molokanov1, R.Yu.. Karmokova1

1 Kabardino-Balkarian State University named after Kh.M. Berbekov
2 North Caucasus Mining and Metallurgical Institute (State Technological University)

DOI: 10.26456/pcascnn/2025.17.537

Original article

Abstract: Increasing the stability and reliability of perovskite solar-to-electric energy converters is one of important issues in the field of green energy. In this regard, a new model of the solar cell structure is proposed that is capable of stabilizing photoelectric characteristics at a level approaching the theoretical limit for a single-layer perovskite. The influence of defect concentration on the characteristics of solar energy conversion into electrical energy in perovskite solar cells in the ITO/ZnO/CH3NH3PbI3/NiO/Ag structure model is considered. Numerical calculations performed show a significant dependence of the solar cell characteristics on the defect density at the layer boundaries and in the perovskite absorber itself. The dependences of the photoelectric efficiency characteristics of the solar cell on the defect density at the oxide heterojunctions with the absorber and the absorber itself are established. In the studied structure, the limit values of defect concentration were established, below which the maximum values of open-circuit voltage, short-circuit current density, photoelectric efficiency, and efficiency are achieved. The concentration of defects at the CH3NH3PbI3/NiO interphase boundary has virtually no effect on their values. A volt-ampere characteristic has been constructed for the proposed model and optimal photoelectric characteristics have been calculated.

Keywords: efficiency factor, perovskite, solar cell, zinc oxide, nickel oxide, defects, interface

  • Artur Z. Agoev – engineer of the scientific and technological center of microelectronics and nanotechnology, Kabardino-Balkarian State University named after Kh.M. Berbekov
  • Akhmed M. Karmokov – Dr. Sc., Professor, Department of Electronics and Digital Information Technologies, Kabardino-Balkarian State University named after Kh.M. Berbekov
  • Evgeny N. Kozyrev – Dr. Sc., Professor, Head of the Department of Electronic Devices, North Caucasus Mining and Metallurgical Institute (State Technological University)
  • Oleg A. Molokanov – Ph. D. Docent, Department of Electronics and Digital Information Technologies, Kabardino-Balkarian State University named after Kh.M. Berbekov
  • Rita Yu.. Karmokova – Ph. D., Docent, Department of Electronics and Digital Information Technologies, Kabardino-Balkarian State University named after Kh.M. Berbekov

For citation:

Agoev A.Z., Karmokov A.M., Kozyrev E.N., Molokanov O.A., Karmokova R.Yu.. Vliyanie kontsentratsii defektov v perovskite i geteroperekhodakh na fotoelektricheskie kharakteristiki solnechnogo elementa [Effect of defect concentration in perovskite and heterojunctions on photovoltaic characteristics of a solar], Fiziko-khimicheskie aspekty izucheniya klasterov, nanostruktur i nanomaterialov [Physical and chemical aspects of the study of clusters, nanostructures and nanomaterials], 2025, issue 17, pp. 537-543. DOI: 10.26456/pcascnn/2025.17.537.

Full article (in Russian): download PDF file

References:

1. Movla H. Optimization of the CIGS based thin film solar cells: Numerical simulation and analysis, Optik, 2014, vol. 125, issue 1, pp. 67-70. DOI: 10.1016/j.ijleo.2013.06.034.
2. Mostefaoui M., Mazari H., Khelifi S., Bouraiou A., Dabou R. Simulation of high efficiency CIGS Solar cells with SCAPS-1D software, Energy Procedia, 2015, vol. 74, pp. 736-744. DOI: 10.1016/j.egypro.2015.07.809.
3. Zhou Y., Gray-Weale A. A numerical model for charge transport and energy conversion of perovskite solar cells, Physical Chemistry Chemical Physics, 2016, vol. 18, issue 6, pp. 4476-4486. DOI: 10.1039/c5cp05371d.
4. Decock K., Khelifi S., Burgelman M. Modelling multivalent defects in thin film solar cells, Thin Solid Films, 2011, vol. 519, issue 21, pp. 7481-7484. DOI: 10.1016/j.tsf.2010.12.039.
5. Burgelman M., Verschraegen J. Numerical modeling of intra-band tunneling for heterojunction solar cells in SCAPS, Thin Solid Films, 2007, vol. 515, issue 15, pp. 6276-6279. DOI: 10.1016/j.tsf.2006.12.049.
6. Burgelman M., Verschraegen J., Degrave S., Nollet P. Modeling thin-film devices, Progress in Photovoltaics: Research and Applications, 2004, vol. 12, issue 2-3, pp. 143-153. DOI: 10.1002/pip.524.
7. Yakovleva N. I. Processy rekombinacii i analiz vremeni zhizni v uzkozonnykh poluprovodnikovykh strukturakh CdHgTe [Recombination processes and lifetime analysis in narrow-gap semiconductor structures CdHgTe], Uspekhi prikladnoy fiziki [Advances in Applied Physics], 2015, vol. 3, no. 2, pp. 169-179. (In Russian).
8. Burgelman M., Nollet P., Degrave S. Modelling polycrystalline semiconductor solar cells, Thin Solid Films, 2000, vol. 361-362, pp. 527-532. DOI: 10.1016/S0040-6090(99)00825-1.
9. Danladi E., Shuaibu A., Ahmad M.S., Tasiu J. Numerical modeling and analysis of HTM-free heterojunction solar cell using SCAPS-1D, East European Journal of Physics, 2021, vol. 2, pp. 135-145. DOI: 10.26565/2312-4334-2021-2-11.
10. Danladi E., Salawu A.O., Abdulmalik M.O. et al. Optimization of absorber and ETM layer thickness for enhanced tin based perovskite solar cell performance using SCAPS-1D software, Physics Access, 2022, vol. 2, issue 1, pp. 1-11. DOI: 10.47514/phyaccess.2022.2.1.001.
11. Wei R. Modelling of perovskite solar cells, Masters by Research thesis. Queensland, Queensland University of Technology, 2018, 81 p.
12. Hossain M.I., Alharbi F.H., Tabet N.A. Copper oxide as inorganic hole transport material for lead halide perovskite-based solar cells, Solar Energy, 2015, vol. 120, pp. 370-380. DOI: 10.1016/j.solener.2015.07.040.
13. Yang D., Yang Z., Qin W. et al. Alternating precursor layer deposition for highly stable perovskite films towards efficient solar cells using vacuum deposition, Journal of Materials Chemistry A, 2015, vol. 3, issue 18, pp. 9401-9405. DOI: 10.1039/C5TA01824B.
14. Chen D., Wang Y., Lin Z. et al. Growth strategy and physical properties of the high mobility of P-types CuI сrystal, Crystal Growth & Design, 2010, vol. 10, issue 5, pp. 2057-2060. DOI: 10.1021/cg100270d.
15. Kurnia F., Jung H.C.U., Liu C. et al. Effect of NiO growth conditions on the bipolar resistance memory switching of Pt/NiO/SRO structure, Journal of Korean Physical Society, 2010, vol. 57, issue 61, pp. 1856-1861. DOI: 10.3938/jkps.57.1856.

⇐ Prevoius journal article | Content | Next journal article ⇒