<p>The expansion of renewable energy applications is essential for reducing carbon emissions. To promote environmentally friendly photovoltaic technologies, this study optimizes the performance of lead-free FASnI<sub>3</sub> perovskite solar cells by introducing ZnO nanowires (NW) as the electron transport layer (ETL). Based on SCAPS-1D simulations, the effects of four key parameters—absorber thickness, bulk defect density, interfacial defect density, and ETL doping concentration-were systematically analyzed. The optimized device, with an absorber thickness of 300 nm, achieves a power conversion efficiency (PCE) of 17.21%, balancing light absorption and carrier transport. As the bulk defect density increases beyond 4.0 × 10<sup>17</sup>cm<sup>−3</sup>, device performance deteriorates rapidly, and the efficiency drops to 2.14% at 4.0 × 10<sup>19</sup>cm<sup>−3</sup>. The impact of interfacial defects is relatively small, with a PCE loss of less than 10%, underscoring the importance of bulk defect passivation. Moderate ETL doping concentrations (10<sup>17</sup>-10<sup>18</sup>cm<sup>−3</sup>) enhance carrier extraction, whereas excessive doping (&gt; 10<sup>19</sup>cm<sup>−3</sup>) causes band misalignment and recombination losses. Replacing planar ZnO or TiO<sub>2</sub>/SnO<sub>2</sub> ETLs with ZnO nanowires further improves charge extraction, reduces interfacial recombination, and enables low-temperature, lead-free processing compatibility. These findings highlight the synergistic effects of structural and electronic optimization and provide theoretical guidance for designing high-efficiency, stable, and environmentally sustainable perovskite solar cells.</p>

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Application of SCAPS-1D simulation in investigating ZnO nanowires as electron transport layers for lead-free FASnI3 perovskite solar cells

  • Bing Liu,
  • Li Zhu,
  • Zirui Li

摘要

The expansion of renewable energy applications is essential for reducing carbon emissions. To promote environmentally friendly photovoltaic technologies, this study optimizes the performance of lead-free FASnI3 perovskite solar cells by introducing ZnO nanowires (NW) as the electron transport layer (ETL). Based on SCAPS-1D simulations, the effects of four key parameters—absorber thickness, bulk defect density, interfacial defect density, and ETL doping concentration-were systematically analyzed. The optimized device, with an absorber thickness of 300 nm, achieves a power conversion efficiency (PCE) of 17.21%, balancing light absorption and carrier transport. As the bulk defect density increases beyond 4.0 × 1017cm−3, device performance deteriorates rapidly, and the efficiency drops to 2.14% at 4.0 × 1019cm−3. The impact of interfacial defects is relatively small, with a PCE loss of less than 10%, underscoring the importance of bulk defect passivation. Moderate ETL doping concentrations (1017-1018cm−3) enhance carrier extraction, whereas excessive doping (> 1019cm−3) causes band misalignment and recombination losses. Replacing planar ZnO or TiO2/SnO2 ETLs with ZnO nanowires further improves charge extraction, reduces interfacial recombination, and enables low-temperature, lead-free processing compatibility. These findings highlight the synergistic effects of structural and electronic optimization and provide theoretical guidance for designing high-efficiency, stable, and environmentally sustainable perovskite solar cells.