Design Optimization of Cesium Contents for Mixed Cation MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>-Based Efficient Perovskite Solar Cell

Perovskite solar cells (PSCs) have already been reported as a promising alternative to traditional energy sources due to their excellent power conversion efficiency, affordability, and versatility, which is particularly relevant considering the growing worldwide demand for energy and increasing scar...

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Main Authors: Syed Abdul Moiz, Ahmed N. M. Alahmadi, Mohammed Saleh Alshaikh
Format: Article
Language:English
Published: MDPI AG 2025-07-01
Series:Nanomaterials
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Online Access:https://www.mdpi.com/2079-4991/15/14/1085
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author Syed Abdul Moiz
Ahmed N. M. Alahmadi
Mohammed Saleh Alshaikh
author_facet Syed Abdul Moiz
Ahmed N. M. Alahmadi
Mohammed Saleh Alshaikh
author_sort Syed Abdul Moiz
collection DOAJ
description Perovskite solar cells (PSCs) have already been reported as a promising alternative to traditional energy sources due to their excellent power conversion efficiency, affordability, and versatility, which is particularly relevant considering the growing worldwide demand for energy and increasing scarcity of natural resources. However, operational concerns under environmental stresses hinder its economic feasibility. Through the addition of cesium (Cs), this study investigates how to optimize perovskite solar cells (PSCs) based on methylammonium lead-iodide (MAPbI<sub>3</sub>) by creating mixed-cation compositions of MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub> (x = 0, 0.25, 0.5, 0.75, 1) for devices A to E, respectively. The impact of cesium content on the following factors, such as open-circuit voltage (V<sub>oc</sub>), short-circuit current density (J<sub>sc</sub>), fill factor (FF), and power conversion efficiency (PCE), was investigated using simulation software, with ITO/TiO<sub>2</sub>/MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>/Spiro-OMeTAD/Au as a device architecture. Due to diminished defect density, the device with x = 0.5 (MA<sub>0.5</sub>Cs<sub>0.5</sub>PbI<sub>3</sub>) attains a maximum power conversion efficiency of 18.53%, with a V<sub>oc</sub> of 0.9238 V, J<sub>sc</sub> of 24.22 mA/cm<sup>2</sup>, and a fill factor of 82.81%. The optimal doping density of TiO<sub>2</sub> is approximately 10<sup>20</sup> cm<sup>−3</sup>, while the optimal thicknesses of the electron transport layer (TiO<sub>2</sub>, 10–30 nm), the hole-transport layer (Spiro-OMeTAD, about 10–20 nm), and the perovskite absorber (750 nm) were identified to maximize efficiency. The inclusion of a small amount of Cs may improve photovoltaic responses; however, at elevated concentrations (x > 0.5), power conversion efficiency (PCE) diminished due to the presence of trap states. The results show that mixed-cation perovskite solar cells can be a great commercially viable option because they strike a good balance between efficiency and performance.
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spelling doaj-art-e425c7888bdd4b9e893f003d3b634b342025-08-20T03:08:06ZengMDPI AGNanomaterials2079-49912025-07-011514108510.3390/nano15141085Design Optimization of Cesium Contents for Mixed Cation MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>-Based Efficient Perovskite Solar CellSyed Abdul Moiz0Ahmed N. M. Alahmadi1Mohammed Saleh Alshaikh2Device Simulation Laboratory, Department of Electrical Engineering, College of Engineering and Architecture, Umm Al-Qura University, Makkah 21955, Saudi ArabiaDevice Simulation Laboratory, Department of Electrical Engineering, College of Engineering and Architecture, Umm Al-Qura University, Makkah 21955, Saudi ArabiaDevice Simulation Laboratory, Department of Electrical Engineering, College of Engineering and Architecture, Umm Al-Qura University, Makkah 21955, Saudi ArabiaPerovskite solar cells (PSCs) have already been reported as a promising alternative to traditional energy sources due to their excellent power conversion efficiency, affordability, and versatility, which is particularly relevant considering the growing worldwide demand for energy and increasing scarcity of natural resources. However, operational concerns under environmental stresses hinder its economic feasibility. Through the addition of cesium (Cs), this study investigates how to optimize perovskite solar cells (PSCs) based on methylammonium lead-iodide (MAPbI<sub>3</sub>) by creating mixed-cation compositions of MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub> (x = 0, 0.25, 0.5, 0.75, 1) for devices A to E, respectively. The impact of cesium content on the following factors, such as open-circuit voltage (V<sub>oc</sub>), short-circuit current density (J<sub>sc</sub>), fill factor (FF), and power conversion efficiency (PCE), was investigated using simulation software, with ITO/TiO<sub>2</sub>/MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>/Spiro-OMeTAD/Au as a device architecture. Due to diminished defect density, the device with x = 0.5 (MA<sub>0.5</sub>Cs<sub>0.5</sub>PbI<sub>3</sub>) attains a maximum power conversion efficiency of 18.53%, with a V<sub>oc</sub> of 0.9238 V, J<sub>sc</sub> of 24.22 mA/cm<sup>2</sup>, and a fill factor of 82.81%. The optimal doping density of TiO<sub>2</sub> is approximately 10<sup>20</sup> cm<sup>−3</sup>, while the optimal thicknesses of the electron transport layer (TiO<sub>2</sub>, 10–30 nm), the hole-transport layer (Spiro-OMeTAD, about 10–20 nm), and the perovskite absorber (750 nm) were identified to maximize efficiency. The inclusion of a small amount of Cs may improve photovoltaic responses; however, at elevated concentrations (x > 0.5), power conversion efficiency (PCE) diminished due to the presence of trap states. The results show that mixed-cation perovskite solar cells can be a great commercially viable option because they strike a good balance between efficiency and performance.https://www.mdpi.com/2079-4991/15/14/1085solar cellperovskite solar cellmixed-cationMA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>caesiumpower conversion efficiency
spellingShingle Syed Abdul Moiz
Ahmed N. M. Alahmadi
Mohammed Saleh Alshaikh
Design Optimization of Cesium Contents for Mixed Cation MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>-Based Efficient Perovskite Solar Cell
Nanomaterials
solar cell
perovskite solar cell
mixed-cation
MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>
caesium
power conversion efficiency
title Design Optimization of Cesium Contents for Mixed Cation MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>-Based Efficient Perovskite Solar Cell
title_full Design Optimization of Cesium Contents for Mixed Cation MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>-Based Efficient Perovskite Solar Cell
title_fullStr Design Optimization of Cesium Contents for Mixed Cation MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>-Based Efficient Perovskite Solar Cell
title_full_unstemmed Design Optimization of Cesium Contents for Mixed Cation MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>-Based Efficient Perovskite Solar Cell
title_short Design Optimization of Cesium Contents for Mixed Cation MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>-Based Efficient Perovskite Solar Cell
title_sort design optimization of cesium contents for mixed cation ma sub 1 x sub cs sub x sub pbi sub 3 sub based efficient perovskite solar cell
topic solar cell
perovskite solar cell
mixed-cation
MA<sub>1−x</sub>Cs<sub>x</sub>PbI<sub>3</sub>
caesium
power conversion efficiency
url https://www.mdpi.com/2079-4991/15/14/1085
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