Performance evaluation of organometal halide MASnI3 and inorganic BaZrS3 hybrids in perovskites solar cells: Theoretical approach

Hybrid Advances Pub Date : 2025-02-17 DOI:10.1016/j.hybadv.2025.100408

Syed M. Hasnain , Abid Iqbal , Irfan Qasim , Kamran Irshad , M. Amin Mir , Muhammad Imran Malik , L. Syam Sundar

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Abstract

Perovskite solar cells have made substantial progress in efficiency and technology for the future photovoltaic systems. Study investigates effect of absorber layer composition on effectiveness power conversion efficiency of solar cell configured with ITO/ZnO/MASnI₃/CuSCN/Au and ITO/ZnO/BaZrS₃/CuSCN/Au material. Using SCAPS-1D simulation tool, the optimized structural layer thicknesses, maximize device efficiency was analyzed. The MASnI₃-based perovskite solar cells consistently outperformed their BaZrS₃ counterparts, with optimized thicknesses of 0.03 μm for the ZnO layer and 0.8 μm for the MASnI₃ absorber layer, yielding a PCE of 20.17 %, an open-circuit voltage (V_oc) of 0.8378 V, a short-circuit current density (J_sc) of 34.18 mA/cm² and a fill factor (FF) of 70.45 %. Conversely, the BaZrS₃-based cells, with optimal thicknesses of 0.04 μm for the ZnO layer and 0.50 μm for the BaZrS₃ absorber layer, achieved a PCE of 8.28 %, a V_oc of 1.3758 V, a J_sc of 13.92 mA/cm², and an FF of 43.24 %.

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有机金属卤化物MASnI3和无机BaZrS3杂化物在钙钛矿太阳能电池中的性能评价：理论方法

钙钛矿太阳能电池在未来光伏系统的效率和技术方面取得了实质性进展。研究了吸收层组成对ITO/ZnO/MASnI3/CuSCN/Au和ITO/ZnO/BaZrS3/CuSCN/Au材料配置的太阳能电池有效功率转换效率的影响。利用SCAPS-1D仿真工具，对优化后的结构层厚度、器件效率最大化进行了分析。基于MASnI3的钙钛矿太阳能电池的性能一直优于BaZrS3电池，ZnO层厚度为0.03 μm， MASnI3吸收层厚度为0.8 μm， PCE为20.17%，开路电压（Voc）为0.8378 V，短路电流密度（Jsc）为34.18 mA/cm2，填充系数（FF）为70.45%。相反，当ZnO层厚度为0.04 μm， BaZrS3吸收层厚度为0.50 μm时，电池的PCE为8.28%，Voc为1.3758 V， Jsc为13.92 mA/cm2， FF为43.24%。

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Hybrid Advances

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