The present work mainly describes the fabrication and characterization (structural, micro-structural, dielectric, piezoelectric, optical, and energy-harvesting) of Ca1-xZnx(Fe0.5V0.5)O3 with x = 0, 0.05, 0.10, and 0.15 complex perovskite. All four compounds are prepared by using the solid-state reaction method (calcination temperature = 1100 °C (6 h) and sintering temperature = 1150 °C (7 h)). The room temperature XRD data analysis confirms all four compounds' single-phase orthorhombic structures. Different modes of vibrations are confirmed by Raman spectroscopy. The grain size increases from 1.09 μm to 2.53 μm with increased zinc concentration. The variation of dielectric constant with frequency has been explained based on Maxwell-Wagner polarization. The effects of grain and grain boundary have been confirmed by impedance spectroscopy, which contributes to the conduction and relaxation mechanism of the compounds. The d33, g33, and energy harvesting performance gradually increase with an increase in zinc concentration, confirming the enhancement of the compounds' piezoelectric properties. The decrease in the band gap from 3.58 eV (x = 0) to 3.00 eV (x = 0.15) confirms the enhancement of optical properties.
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