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Pioneering non-thermal plasma as a defect passivator: a new Frontier in ambient metal halide perovskite synthesis

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A novel investigation of pressure-induced semiconducting to metallic transition of lead free novel Ba3SbI3 perovskite with exceptional optoelectronic properties

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Band gap engineering in lead free halide cubic perovskites GaGeX3 (X = Cl, Br, and I) based on first-principles calculations

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Unlocking the potential of selenium solar cells for indoor and tandem photovoltaics through theoretical and photoelectric simulations

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A comprehensive investigation of the Sr3AsX3 (X = F/Cl/Br) inorganic cubic perovskites’ strain-induced structural, electronic, optical, and mechanical properties with solar cell applications

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Numerical modeling and extensive analysis of an extremely efficient RbGeI3-based perovskite solar cell by incorporating a variety of ETL and HTL materials to enhance PV performance

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Investigating pressure-driven semiconductor-to-metal transition in lead-free perovskites AlGeX3 (X = F, Cl, and Br): insights from first-principles calculations

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Exploration of the photovoltaic properties of oxide-based double perovskite Bi2FeCrO6 using an amalgamation of DFT with spin–orbit coupling effect and SCAPS-1D simulation approaches

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Design and analysis of a SnS2/WS2/V2O5 double-heterojunction toward high-performance photovoltaics

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Energy Adv., 2023, 2, 1843
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Efficiency enhancement of perovskite solar cell devices utilizing MXene and TiO2 as an electron transport layer

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Achieving above 24% efficiency with non-toxic CsSnI3 perovskite solar cells by harnessing the potential of the absorber and charge transport layers

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Lead-free, formamidinium germanium-antimony halide (FA4GeSbCl12) double perovskite solar cells: the effects of band offsets

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Solar power conversion: CuI hole transport layer and Ba3NCl3 absorber enable advanced solar cell technology boosting efficiency over 30%

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Boosting efficiency above 28% using effective charge transport layer with Sr3SbI3 based novel inorganic perovskite

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Analytical detection of the bioactive molecules dopamine, thyroxine, hydrogen peroxide, and glucose using CsPbBr3 perovskite nanocrystals

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Improving the efficiency of a CIGS solar cell to above 31% with Sb2S3 as a new BSF: a numerical simulation approach by SCAPS-1D

Md. Ferdous Rahman, Mithun Chowdhury, Latha Marasamy, Mustafa K. A. Mohammed, Md. Dulal Haque, Sheikh Rashel Al Ahmed, Ahmad Irfan, Aijaz Rasool Chaudhry and Souraya Goumri-Said

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Design and simulation of the potential of lead-free Ag3Bi1.1I6.3 perovskite solar cells with different charge transport for energy enhancement

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Enhancing solar cell efficiency beyond 27% through the implementation of an efficient charge transport layer utilizing an innovative inorganic perovskite Sr3PI3

Avijit Ghosh, Abu Bakkar, Momina, Nimra Asmat, Ferdous Ahmed, Mohammad Fokhrul Islam Buian, Muhammad Sajid, Jothi Ramalingam Rajabathar, Abdulnasser Mahmoud karami, Anup Nandi and Md Aminul Islam

Journal of Physics and Chemistry of Solids, 2024, 190, 112029
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A new class of SrHfSe3 chalcogenide perovskite solar cells with diverse HTMs: Theoretical modelling towards efficiency enhancement

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Solar Energy Materials and Solar Cells, 2025, 290, 113727
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Introducing a sustainable strontium-based double perovskite solar cell exceeding 32 % efficiency for advanced solar technology

Basra Sultana, Abu Bakkar, Okba Saidani, Sagar Bhattarai, Ahmad Irfan and Md. Ferdous Rahman

Journal of Physics and Chemistry of Solids, 2025, 200, 112582
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Design of Next‐Generation Tin‐Based Perovskite Photodetector with Enhanced Spectral Responsivity for Eco‐friendly Applications

Pallavi Pandey, Akhilesh Kumar Chaudhary and Sudhanshu Verma

Physica Status Solidi (b), 2024
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High-Efficiency Lead-Free La2NiMnO6-Based Double Perovskite Solar Cell by Incorporating Charge Transport Layers Composed of WS2, ZnO, and Cu2FeSnS4

M. Khalid Hossain, A. A. Arnab, G. F. Ishraque Toki, Sagar Bhattarai, Ahmed M Tawfeek, H. Bencherif, D. K. Dwivedi, Jaya Madan and Rahul Pandey

Energy Fuels, 2023, 37, 19898
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Unraveling the strain-induced and spin–orbit coupling effect of novel inorganic halide perovskites of Ca3AsI3 using DFT

Md. Ferdous Rahman, Md. Azizur Rahman, Md. Rasidul Islam, Avijit Ghosh, Md. Abul Bashar Shanto, Mithun Chowdhury, Md. Al Ijajul Islam, Md. Hafizur Rahman, M. Khalid Hossain and M. A. Islam

AIP Advances, 2023, 13
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Unveiling the potential of non-toxic Ge based perovskite material for all inorganic solar cells using multiple ETLs

Fozlur Rayhan, Md Hamidur Rahman, Sohel Rana, Dipika Das Ria, Jannati Islam Chy, Md Shakib Hosen, Tanzir Ahamed, Jerry Sarpong, Kelly Yegbe and Md Shihab Uddin

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Cs Content‐Dependent Photovoltaic Performance of CsxRb1−xPbI3‐Based Perovskite Solar Cells

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Physica Status Solidi (a), 2025
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Numerical investigation of Aloe Vera-mediated green synthesized CuAlO 2 as HTL in Pb-free perovskite solar cells

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Journal of Taibah University for Science, 2024, 18
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A numerical investigation to design and performance optimization of lead-free Cs2TiCl6 based perovskite solar cells with different charge transport layers

Sahjahan Islam, M. Khalid Hossain, M. Shihab Uddin, P. Prabhu, Suhas Ballal, K. Phaninder Vinay, V. Kavitha, Satish Kumar Samal, Abdullah M. S. Alhuthali, Mongi Amami, A. Kumar Datta, Gazi F. I. Toki and Rajesh Haldhar

Sci Rep, 2025, 15
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Photovoltaic performance analysis of CH3NH3PbI3 perovskite solar cell using SCAPS simulation

Nowrin Nowshad, Rafiqul Islam and Md. Nasir Uddin

Chemistry of Inorganic Materials, 2025, 6, 100107
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Numerical simulation and optimization of all-inorganic P-type heterojunction CsPbIBr2/CsGeI3 perovskite solar cells

Yuxing Gao, Yanhua Zhang, Zhuoxin Dong, Wenjing Gao, Wenjie Zhang, Nan Zhao, Bo Liu, Min Li, Cheng Peng and Jiang Wu

Journal of Physics and Chemistry of Solids, 2026, 208, 113177
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Theoretical insights into lead-free planer Cs2AuBiCl6 based double perovskite solar cells with various charge transport layers via numerical analysis

Apon Kumar Datta, M. Khalid Hossain, M. Shihab Uddin, Abhinav Kumar, Ashish Agrawal, H. Bencherif, Nouf H. Alotaibi and V.K. Mishra

Journal of Physics and Chemistry of Solids, 2025, 206, 112872
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Optimized dual absorber architecture for enhanced efficiency and stability in all-inorganic perovskite solar cells

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A review of interface engineering characteristics for high performance perovskite solar cells

George G. Njema, Joshua K. Kibet and Silas M. Ngari

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Advanced Optimization of Bandgap Grading Techniques in CsPbBr3−xIx Perovskite Solar Cells for Achieving Remarkable 30.96% Efficiency

Akash Anand Verma, D. K. Dwivedi, Pooja Lohia, Rahul Pandey, Jaya Madan, Upendra Kulshrestha and Manish Kumar

J Inorg Organomet Polym, 2025
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Boosting efficiency above 30 % of novel inorganic Ba3SbI3 perovskite solar cells with potential ZnS electron transport layer (ETL)

Md. Ferdous Rahman, Md. Naim Hasan Toki, Abdul Kuddus, Mustafa K.A. Mohammed, Md. Rasidul Islam, Sagar Bhattarai, Jaya Madan, Rahul Pandey, Riadh Marzouki and Mosbah Jemmali

Materials Science and Engineering: B, 2024, 300, 117073
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HTL-free non-toxic perovskite tandem solar device MAGeI3/FASnI3 with 25.69% efficiency: design and simulation using SCAPS

Youssef El Arfaoui, Mohammed Khenfouch and Nabil Habiballah

J Opt, 2024, 53, 4452
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Constructing Hybrid Semiconductor Thin‐Films for Advanced Photovoltaics

Tamsen Orange, Kevin Tambwe, Christopher Arendse, Thembinkosi Malevu and Natasha Ross

ChemistrySelect, 2024, 9
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Numerical Investigation of a Highly Efficient Hole Transport Layer-Free Solid-State Dye-Sensitized Solar Cell Based on N719 Dye

George G. Njema, Joshua K. Kibet, Nicholas Rono and Edson L. Meyer

J. Electron. Mater., 2024, 53, 3368
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Lead-free novel perovskite Ba3AsI3: First-principles insights into its electrical, optical, and mechanical properties

Pobitra Barman, Md. Ferdous Rahman, Md. Rasidul Islam, Mehedi Hasan, Mithun Chowdhury, M. Khalid Hossain, Jibon Krishna Modak, Safa Ezzine and Mongi Amami

Heliyon, 2023, 9, e21675
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Improving the Efficiency of a New Perovskite Solar Cell Based on Sr3SbI3 by Optimizing the Hole Transport Layer

Md. Shamim Reza, Md. Ferdous Rahman, Abdul Kuddus, Md. Selim Reza, Md. Abdul Monnaf, Md. Rasidul Islam, Sagar Bhattarai, Samah Al-Qaisi, Lamia Ben Farhat and Safa Ezzine

Energy Fuels, 2024, 38, 2327
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Boosting the effectiveness of a cutting-edge Ca3NCl3 perovskite solar cell by fine-tuning the hole transport layer

Md. Shamim Reza, Avijit Ghosh, Abul Kalam Azad, Md. Selim Reza, Md. Mahfuz Hossain, Asif Ahammad Miazee, Nasser S. Awwad, Md Saiful Islam and Hala A. Ibrahium

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Low-cost lead-free perovskite solar cell with graphene oxide as hole transport layer and carbon as back contact

Akhilesh Kumar Chaudhary, Sudhanshu Verma and R.K. Chauhan

Optik, 2023, 295, 171469
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Improving the power conversion efficiency of RbPbBr3 absorber based solar cells through the variation of efficient hole transport layers

Avijit Ghosh, Mohammad Shakhawat Hossain, Ferdous Ahmed, Mst. Miftahul Jannat Juhi, Md. Mahbubur Rahman, Nasser S. Awwad, Hala A. Ibrahium, Rafin Kabir, Md Farad Ahmmed, Md. Maniruzzaman and Md Muminur Rahman Sonic

Journal of Physics and Chemistry of Solids, 2024, 193, 112179
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Impact on green energy conversion and stability of PSC device with the insertion of bifunctional molecule as an interfacial layer

Meena Devi, Manish Kumar and Dharm Veer Singh

Journal of Physics and Chemistry of Solids, 2024, 194, 112247
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Unleaded all-inorganic KSnI3 perovskite solar cell: A computational study

Grishma Pindolia and Satyam M. Shinde

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Microwave fostered sustainable synthesis of Nb2O5 – ZnO nanomaterial for efficiency amplification in high performing energy systems

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Boosting solar cell performance: optimization of WS2 absorber with Cu2O HTL & ZnSe ETL using SCAPS-1D simulation

Muhammad Sajid, Khuram Ali, Humayon Shehzad Shah, Asma Shahid, Suriani Abu Bakar, Muhammad Yousaf and Shern-Long Lee

J Opt, 2024
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DFT insights into bandgap engineering of lead-free LiMCl3 (M = Mg, Be) halide perovskites for optoelectronic device applications

Apon Kumar Datta, M. Khalid Hossain, Md. Shahriar Rahman, Prabhu Paramasivam, Adel El-marghany and V. K. Mishra

Sci Rep, 2025, 15
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Pressure-induced structural, electronic, optical, and mechanical properties of lead-free GaGeX3 (X = Cl, Br and, I) perovskites: First-principles calculation

Md. Mehedi Hasan, Md. Amran Sarker, Mohshina Binte Mansur, Md. Rasidul Islam and Sohail Ahmad

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Unlocking high-efficiency solar energy: optimizing P3HT/Si hybrid solar cells through numerical simulation

Sijo A K, Akhil Krishnan, P Sapna and Emmanuel Tom

Phys. Scr., 2024, 99, 115950
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Design and Optimization of High-Performance Novel RbPbBr3-Based Solar Cells with Wide-Band-Gap S-Chalcogenide Electron Transport Layers (ETLs)

Md. Selim Reza, Md. Ferdous Rahman, Abdul Kuddus, Mustafa K. A. Mohammed, Debashish Pal, Avijit Ghosh, Md. Rasidul Islam, Sagar Bhattarai, Ibrahim A. Shaaban and Mongi Amami

ACS Omega, 2024, 9, 19824
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Broadening light absorption and reducing recombination in DSSCs with Eu-doped BaTiO3@CaF2/TiO2 hybrid systems

Tatiane Strelow Lilge, Luciano Timm Gularte, Cristian Dias Fernandes, Tatiane Manke da Rocha, Mario Lucio Moreira, Mário Ernesto Giroldo Valerio and Zélia Soares Macedo

Optical Materials, 2025, 162, 116894
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Deep insights on the performance of different structures of InGaN-based tandem photovoltaic cells: path towards the design of high efficiency PV modules

Y. Marouf, L. Dehimi, H. Bencherif, F. Pezzimenti, Z. Younsi, Munirah D. Albaqami, Sara H. Shahatha, M. R. Mohammad, Gazi F. I. Toki, D. K. Dwivedi and M. Khalid Hossain

J Opt, 2024
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Influence of 10 nm Hole and Electron Transport Layers on Enhancing the Efficiency of Elpasolite Solar Cell (ESC) With Dual Light Active Layers for Nanostructured Photovoltaic Applications

G. P. S. Prashanthi and Umakanta Nanda

IEEE Access, 2024, 12, 114995
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Optimized RbPbI3-Based perovskite solar cells with SnS2 ETL and MoO3 HTL achieving simulated PCE of 32.72%

Md. Ariful Islam Bhuiyan, Md. Shamim Reza, Avijit Ghosh, Hmoud Al-Dmour, Yedluri Anil Kumar, Muhammad Ihsan Ibn Rahim, Md. Aktarujjaman, Fahima Yeasmin, Hamad Al-Lohedan, R. Jothi Ramalingam and Md. Selim Reza

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A comprehensive investigation involving numerous HTL and ETL layers to design and simulate high-efficiency Ca3AsI3-based perovskite solar cells

Md. Selim Reza, Avijit Ghosh, Abdelaziz Gassoumi, Md Rafid Hasan, Mohammad Shahjalal, Abul Kashem Mohammad Yahia, Md. Shamim Reza, Ripan Kumar Prodhan, Md Majharul Islam, Md Jakaria Talukder, Aijaz Rasool Chaudhry and Mst. Mohona Akter

Inorganic Chemistry Communications, 2025, 172, 113647
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Strategic design and evaluation of charge transport layers for high-efficiency lead-free BeSiP2-based perovskite solar cells: A careful examination into electron and hole transport layers

Md. Shamim Reza, Avijit Ghosh, Md. Selim Reza, Sabina Sultana, Nasser S. Awwad and Huriyyah A. Alturaifi

Solar Energy, 2025, 287, 113210
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A numerical approach to optimize the performance of HTL-free carbon electrode-based perovskite solar cells using organic ETLs

Sumbel Ijaz, Ehsan Raza, Zubair Ahmad, Haris Mehmood, Muhammad Zubair, Muhammad Qasim Mehmood and Yehia Massoud

Heliyon, 2024, 10, e29091
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Optimization of the architecture of lead-free CsSnCl3-perovskite solar cells for enhancement of efficiency: A combination of SCAPS-1D and wxAMPS study

M. Khalid Hossain, G.F. Ishraque Toki, A. Kuddus, Mustafa K.A. Mohammed, Rahul Pandey, Jaya Madan, Sagar Bhattarai, Md. Ferdous Rahman, D.K. Dwivedi, Mongi Amami, H. Bencherif and D.P. Samajdar

Materials Chemistry and Physics, 2023, 308, 128281
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Novel double graded perovskite materials for performance increment of perovskite solar cell using extensive numerical analysis

Sagar Bhattarai, Deepthi Jayan, Abderrahim Yousfi, Mithun Chowdhury, Md Ferdous Rahman, Rahul Pandey, Jaya Madan, Mohd Zahid Ansari and M Khalid Hossain

Phys. Scr., 2023, 98, 095507
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A DFT-based computational study on a highly and lead-free inorganic new fluoroperovskite of Mg3PF3

Md. Ferdous Rahman, Md. Hafizur Rahman, Tanvir Al Galib, Ahsan Habib and Ahmad Irfan

Physics Letters A, 2024, 528, 130027
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Strain effect on the physical properties of novel Mg3NI3 perovskite material: First principle DFT analysis

I.K. Gusral Ghosh Apurba, Md Rasidul Islam, Md Shizer Rahman, Nazia Iram, Md Ferdous Rahman and Sohail Ahmad

Journal of Physics and Chemistry of Solids, 2025, 197, 112435
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From single optimized cell to photovoltaic panel: Lead-Free Cs2AgBiBr6 perovskite module under the semi-arid climate of Meknes

I. Chabri, N. Fangachi, M. Said, O. Fangachi, M. Yessari and A. Oubelkacem

Solar Energy Materials and Solar Cells, 2026, 294, 113915
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A novel design and optimization of Si based high performance double absorber heterojunction solar cell

Basra Sultana, Md. Ferdous Rahman, Amaresh Chandra Roy, Md. Masum Mia, Md. Al Ijajul Islam, Ahmad Irfan, Aijaz Rasool Chaudhry and Md. Dulal Haque

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Numerical and Experimental Validation of CsPbBr3 Perovskite Solar Cells: Insights on a One-Step Deposition Technique

Soumya Sundar Parui, Krishnapressad Vijayan, Nithin Xavier, R Ramesh Babu and Vipul Kheraj

J. Phys. Chem. C, 2025, 129, 7625
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Lead-free Ge-based perovskite solar cell incorporating TiO2 and Cu2O charge transport layers harnessing over 25% efficiency

M. Shihab Uddin, Md. Abdullah Al Mashud, G. F. Ishraque Toki, Rahul Pandey, Muhammad Zulfiqar, Okba Saidani, Karnan Chandran, Mohamed Ouladsmane and M. Khalid Hossain

J Opt, 2024, 53, 3726
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Theoretical Simulation on Enhancing the Thin-Film Copper Zinc Tin Sulfide Solar Cell Performance Using MoS2, MoOx, and CuI as Efficient Hole Transport Layers

Siham Mansouri, Lakhdar Dehimi, Hichem Bencherif, F. Pezzimenti, Muhammad Zulfiqar, Nouf H. Alotaibi, Saikh Mohammad, Rajesh Haldhar, Moustafa A. Darwish and M. Khalid Hossain

Energy Fuels, 2024, 38, 8187
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Enhancement of efficiency in CsSnI3 based perovskite solar cell by numerical modeling of graphene oxide as HTL and ZnMgO as ETL

Sagar Bhattarai, M. Khalid Hossain, Rahul Pandey, Jaya Madan, D.P. Samajdar, Mithun Chowdhury, Md. Ferdous Rahman, Mohd Zahid Ansari and Munirah D. Albaqami

Heliyon, 2024, 10, e24107
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A numerical approach to optimize the efficiency of a novel HTL-free Sr3Ti2S7 Ruddlesden-Popper perovskite solar cell

Debashish Pal, Soumee Das, M. Khalid Hossain, M.R. Mohammad, Mohammad R. Karim, Rajesh Haldhar and T.S. Soliman

Inorganic Chemistry Communications, 2024, 165, 112529
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Unlocking the Potential of Emerging SrZrSe3 Solar Cells with Diverse Inorganic Metal Sulfide Hole Transport Layers

Eupsy Navis Vincent Mercy, Aruna‐Devi Rasu Chettiar, Dhineshkumar Srinivasan and Latha Marasamy

Energy Tech, 2025, 13
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An in-depth study on charge transport layers for designing and optimizing high-efficiency lead-free CsSnGeI3-based double-perovskite solar cells: A numerical approach

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Comprehensive analysis of heterojunction compatibility of various perovskite solar cells with promising charge transport materials

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Tailoring transporters for all-inorganic tin-based perovskite solar cells with efficiency exceeding 22% using SCAPS-1D simulator

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Numerical Analysis and Design of Hole and Electron Transport Layers in Lead-Free MASnIBr2 Perovskite Solar Cells

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Design of Perovskite‐Based Photodetector Demonstrating Wide Spectral Responsivity Employing Graphene Oxide for Enhanced Electron Transport

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In‐Depth Review of Multiphysics and Circuit Simulation Approaches for Perovskite Solar Cells

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Modeling and optimization of numerical studies on CuSbS2 thin film solar cell with ∼ 15% efficiency

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Enhancing efficiency and performance of Cs2TiI6-based perovskite solar cells through extensive optimization: A numerical approach

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Tuning the physical properties of inorganic novel perovskite materials Ca3PX3 (X=I, Br and Cl): Density function theory

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Modeling of (Ca,Ba)ZrS3 solar cells with next-gen spinel hole transport layers via SCAPS-1D

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Performance assessment of earth-abundant Kesterite and lead-free chalcogenide-based perovskite solar cells using SCAPS-1D

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Numerical simulation of a novel high performance solid‐state dye‐sensitised solar cell based on N719 dye

George G. Njema, Joshua K. Kibet, Nicholas Rono and Chinedu C. Ahia

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