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Numerical modelling of non-fullerene organic solar cell with high dielectric constant ITIC-OE acceptor
摘要: The low dielectric constant of organic semiconductors has been a limiting factor in the organic photovoltaics. Non-Fullerene Acceptor Bulk Heterojunction (NFA-BHJ) organic solar cells with high dielectric constant acceptors have been gaining a lot of attention. No simulation work has been done on NFA-BHJ organic solar cell with a high dielectric constant acceptor so far to study the influence of various material parameters on the device performance. In this work, a comprehensive device modelling of the conventional structure of NFA-BHJ with poly[(2,6-(4,8-bis(5-(2-ethylhexyl)thiophen-2-yl)benzo[1,2-b:4,5-b]dithiophene)-co-(1,3-di(5-thiophene-2-yl)-5,7-bis(2-ethylhexyl)benzo[1,2-c:4,5-c]dithiophene-4,8-dione)] (PBDB-T)as the polymer donor and (3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone)-5,5,11,11-tetraki(4-hexylphenyl)-dithieno [2,3-d:2,3-d]-s-indaceno [1,2-b:5,6-b]dithiophene)) with Oligo-Ethylene side chain (ITIC-OE) as the non-fullerene acceptor is performed. We did a detailed analysis on the impact of technological parameters on the cell performance and optimized the device characteristics to produce improved efficiency. Numerical simulation is done using SCAPS 1-D program and the validity of simulated output has been verified by comparing with the measurements from reported literature. Optimization of the device parameters produced an improved device performance with an open circuit voltage of 0.9562 V, short circuit current density of mA/cm2, Fill factor of 69.75 % and a power conversion efficiency of 11%. The results are encouraging to develop NFA-BHJ organic solar cells with high dielectric constant acceptors in the near future.
关键词: numerical modelling,Non-Fullerene Acceptor Bulk Heterojunction,high dielectric constant,ITIC-OE acceptor,organic solar cells
更新于2025-09-23 15:19:57
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5H-Fluoreno [3,2- b:6,7- b’] Dithiophene Based Non-fullerene Small Molecular Acceptors for Polymer Solar Cell Application
摘要: Two novel non-fullerene small molecule acceptors were prepared with the conjugated backbone of 5H- fluoreno[3, 2- b:6, 7- b’] dithiophene carrying the electron deficient unit of dicyanomethylene indanone (DICTFDT) and rhodanine (TFDTBR), respectively. The two acceptors exhibited excellent thermal stability and strong absorption in the visible region. The LUMO level is estimated to be at -3.89 eV for DICTFDT and -3.77 eV for TFDTBR. When utilized as the acceptor in bulk heterojunction polymer solar cells with the polymer donor of PBT7-Th, the optimized maximum power conversion efficiency of 5.12% and 3.95% was obtained for the device with DICTFDT and TFDTBR, respectively. The research demonstrates that 5H- fluoreno[3, 2- b:6, 7- b’] dithiophene can be an appealing candidate for constructing small molecular electron acceptor towards efficient polymer:non-fullerene bulk heterojunction solar cells.
关键词: polymer solar cells,non-fullerene acceptor,bulk heterojunction
更新于2025-09-16 10:30:52
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Ladder‐Type Nonacyclic Arene Bis(thieno[3,2‐b]thieno)cyclopentafluorene as A Promising Building Block for Non‐Fullerene Acceptor
摘要: A ladder-type nonacyclic arene (bis(thieno[3,2-b]thieno)cyclopentafluorene (BTTF)) has been designed and synthesized through fusing thienothiophenes with the fluorene core from the synthon of dimethyl 9,9-dioctyl-2,7-bis(thieno[3,2-b]thiophen-2-yl)fluorene-3,6-dicarboxylate. With BTTF as the central donor unit, a novel acceptor-donor-acceptor (A-D-A) type non-fullerene small molecule (BTTFIC) was prepared with 1,1-dicyanomethylene-3-indanones (IC) as the peripheral acceptor units. The energy level of the highest occupied molecular orbital (HOMO) and the lowest unoccupied molecular orbital (LUMO) of BTTFIC locate at -5.56 and -3.95 eV, respectively, presenting a low optical band gap of 1.58 eV. Encouragingly, polymer solar cells based on the blends of BTTFIC with both the representative wide and low band gap polymer donors (PBDB-T, 1.82 eV. PTB7-Th, 1.58 eV) offer power conversion efficiencies over 8% (8.78 ± 0.18% for PBDB-T:BTTFIC and 8.18 ± 0.29% for PTB7-Th:BTTFIC). These results highlight the advantage of ladder-type BTTF on the preparation of nonfullerene acceptors with extended conjugated backbones.
关键词: Ladder-type Arene,Non-fullerene Acceptor,Bulk heterojunction,Polymer Solar Cells,Polycyclic Aromatics
更新于2025-09-04 15:30:14