<p>High-efficiency lead-free tandem solar cells were numerically designed using <InlineEquation ID="IEq5"> <EquationSource Format="TEX">\(\hbox {CaV}_{0.5}\hbox {Fe}_{0.5}\hbox {O}_{{3}}\)</EquationSource> <EquationSource Format="MATHML"><math> <mrow> <msub> <mtext>CaV</mtext> <mrow> <mn>0.5</mn> </mrow> </msub> <msub> <mtext>Fe</mtext> <mrow> <mn>0.5</mn> </mrow> </msub> <msub> <mtext>O</mtext> <mn>3</mn> </msub> </mrow> </math></EquationSource> </InlineEquation> as a wide-bandgap top absorber and <InlineEquation ID="IEq6"> <EquationSource Format="TEX">\(\hbox {Ag}_{{2}}\hbox {BeSnX}_{{4}}\)</EquationSource> <EquationSource Format="MATHML"><math> <mrow> <msub> <mtext>Ag</mtext> <mn>2</mn> </msub> <msub> <mtext>BeSnX</mtext> <mn>4</mn> </msub> </mrow> </math></EquationSource> </InlineEquation> (X = Se, Te) kesterites as narrow-bandgap bottom absorbers. These materials combine non-toxicity, earth abundance, and complementary bandgaps suitable for tandem architectures. SCAPS-1D simulations, supported by material parameters from density functional theory and reported experimental data, were employed to optimize absorber thickness, carrier concentration, and band alignment. An optimal conduction band offset of approximately +0.2 eV at the absorber/CdS interface was identified, minimizing interfacial recombination and enhancing carrier extraction. Current matching was achieved at a top-cell thicknesses of 0.46 μm (Se-based) and 0.44 μm (Te-based), yielding matched short-circuit current density of <InlineEquation ID="IEq9"> <EquationSource Format="TEX">\(\sim \)</EquationSource> <EquationSource Format="MATHML"><math> <mo>∼</mo> </math></EquationSource> </InlineEquation>17&#xa0;mA&#xa0;<InlineEquation ID="IEq10"> <EquationSource Format="TEX">\(\hbox {cm}^{-2}\)</EquationSource> <EquationSource Format="MATHML"><math> <msup> <mtext>cm</mtext> <mrow> <mo>-</mo> <mn>2</mn> </mrow> </msup> </math></EquationSource> </InlineEquation>. The optimized <InlineEquation ID="IEq11"> <EquationSource Format="TEX">\(\hbox {CaV}_{0.5}\hbox {Fe}_{0.5}\hbox {O}_{{3}}\)</EquationSource> <EquationSource Format="MATHML"><math> <mrow> <msub> <mtext>CaV</mtext> <mrow> <mn>0.5</mn> </mrow> </msub> <msub> <mtext>Fe</mtext> <mrow> <mn>0.5</mn> </mrow> </msub> <msub> <mtext>O</mtext> <mn>3</mn> </msub> </mrow> </math></EquationSource> </InlineEquation>/<InlineEquation ID="IEq12"> <EquationSource Format="TEX">\(\hbox {Ag}_{{2}}\hbox {BeSnSe}_{{4}}\)</EquationSource> <EquationSource Format="MATHML"><math> <mrow> <msub> <mtext>Ag</mtext> <mn>2</mn> </msub> <msub> <mtext>BeSnSe</mtext> <mn>4</mn> </msub> </mrow> </math></EquationSource> </InlineEquation> tandem device achieved power conversion efficiency of 32.56%, with open-circuit voltage of 2.05&#xa0;V and a fill factor of 93.28%, while the Te-based configuration delivered 24.35% efficiency with <InlineEquation ID="IEq13"> <EquationSource Format="TEX">\(V_{\textrm{oc}}\)</EquationSource> <EquationSource Format="MATHML"><math> <msub> <mi>V</mi> <mtext>oc</mtext> </msub> </math></EquationSource> </InlineEquation> of 1.57&#xa0;V. Impedance analysis confirmed reduced recombination and improved charge transport under optimized conditions. These results demonstrate the strong potential of combining mixed B-site lead-free perovskites with kesterite absorbers for high-performance and environmentally sustainable tandem photovoltaic applications.</p>

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High-Efficiency Lead-Free Tandem Solar Cells Based on CaV0.5Fe0.5O3 and Ag2BeSnX4

  • F. E. Elkezaini,
  • L. B. Drissi,
  • Y. Chrafih

摘要

High-efficiency lead-free tandem solar cells were numerically designed using \(\hbox {CaV}_{0.5}\hbox {Fe}_{0.5}\hbox {O}_{{3}}\) CaV 0.5 Fe 0.5 O 3 as a wide-bandgap top absorber and \(\hbox {Ag}_{{2}}\hbox {BeSnX}_{{4}}\) Ag 2 BeSnX 4 (X = Se, Te) kesterites as narrow-bandgap bottom absorbers. These materials combine non-toxicity, earth abundance, and complementary bandgaps suitable for tandem architectures. SCAPS-1D simulations, supported by material parameters from density functional theory and reported experimental data, were employed to optimize absorber thickness, carrier concentration, and band alignment. An optimal conduction band offset of approximately +0.2 eV at the absorber/CdS interface was identified, minimizing interfacial recombination and enhancing carrier extraction. Current matching was achieved at a top-cell thicknesses of 0.46 μm (Se-based) and 0.44 μm (Te-based), yielding matched short-circuit current density of \(\sim \) 17 mA  \(\hbox {cm}^{-2}\) cm - 2 . The optimized \(\hbox {CaV}_{0.5}\hbox {Fe}_{0.5}\hbox {O}_{{3}}\) CaV 0.5 Fe 0.5 O 3 / \(\hbox {Ag}_{{2}}\hbox {BeSnSe}_{{4}}\) Ag 2 BeSnSe 4 tandem device achieved power conversion efficiency of 32.56%, with open-circuit voltage of 2.05 V and a fill factor of 93.28%, while the Te-based configuration delivered 24.35% efficiency with \(V_{\textrm{oc}}\) V oc of 1.57 V. Impedance analysis confirmed reduced recombination and improved charge transport under optimized conditions. These results demonstrate the strong potential of combining mixed B-site lead-free perovskites with kesterite absorbers for high-performance and environmentally sustainable tandem photovoltaic applications.