<p>Organic–inorganic halide perovskites have emerged as promising materials for optoelectronic applications; however, the presence of toxic lead poses significant environmental and health concerns, motivating the search for lead-free alternatives. In this study, we investigate the effect of substituting lead with bismuth on the structural, morphological, and optical characteristics of halide perovskite thin films. X-ray diffraction analysis reveals that MAPbBr<sub>3</sub> crystallizes in a highly ordered three-dimensional perovskite structure with strong preferential orientation, whereas MA<sub>3</sub>Bi<sub>2</sub>Br<sub>9</sub> forms a low-dimensional, perovskite derived structure consisting of isolated Bi<sub>2</sub>Br<sub>9</sub><sup>3−</sup> units. Morphological studies using scanning electron microscopy show compact, uniform, and densely packed grains in MAPbBr<sub>3</sub> films, while MA<sub>3</sub>Bi<sub>2</sub>Br<sub>9</sub> exhibits discontinuous morphology with irregular grains and increased voids, reflecting altered crystallization behavior due to reduced structural dimensionality. Optical measurements indicate strong visible-light absorption and a direct band gap of ~ 2.28&#xa0;eV for MAPbBr<sub>3</sub>, whereas MA<sub>3</sub>Bi<sub>2</sub>Br<sub>9</sub> displays weaker absorption with a blue-shifted onset and an indirect band gap of ~ 2.67&#xa0;eV. These findings highlight the fundamental trade-off between optoelectronic performance and environmental sustainability upon lead substitution. The study provides critical insights into structure–property relationships in bismuth-based perovskites and underscores their potential and limitations for developing eco-friendly optoelectronic devices.</p>

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Lead to bismuth in halide perovskites: effects on structural and optical characteristics

  • Rahul Palsaniya,
  • Nutan Sharma,
  • Sarita Kumari

摘要

Organic–inorganic halide perovskites have emerged as promising materials for optoelectronic applications; however, the presence of toxic lead poses significant environmental and health concerns, motivating the search for lead-free alternatives. In this study, we investigate the effect of substituting lead with bismuth on the structural, morphological, and optical characteristics of halide perovskite thin films. X-ray diffraction analysis reveals that MAPbBr3 crystallizes in a highly ordered three-dimensional perovskite structure with strong preferential orientation, whereas MA3Bi2Br9 forms a low-dimensional, perovskite derived structure consisting of isolated Bi2Br93− units. Morphological studies using scanning electron microscopy show compact, uniform, and densely packed grains in MAPbBr3 films, while MA3Bi2Br9 exhibits discontinuous morphology with irregular grains and increased voids, reflecting altered crystallization behavior due to reduced structural dimensionality. Optical measurements indicate strong visible-light absorption and a direct band gap of ~ 2.28 eV for MAPbBr3, whereas MA3Bi2Br9 displays weaker absorption with a blue-shifted onset and an indirect band gap of ~ 2.67 eV. These findings highlight the fundamental trade-off between optoelectronic performance and environmental sustainability upon lead substitution. The study provides critical insights into structure–property relationships in bismuth-based perovskites and underscores their potential and limitations for developing eco-friendly optoelectronic devices.