The Influence of CsBr on Crystal Orientation and Optoelectronic Properties of MAPbI3-Based Solar Cells

Author(s):  
Yuqin Zou ◽  
Shuai Yuan ◽  
Ali Buyruk ◽  
Johanna Eichhorn ◽  
Shanshan Yin ◽  
...  
2020 ◽  
Vol 8 (22) ◽  
pp. 11148-11154 ◽  
Author(s):  
Jiawen Wu ◽  
Weihua Zhang ◽  
Qifei Wang ◽  
Shuang Liu ◽  
Jiankang Du ◽  
...  

Controlling the crystal orientation of organic–inorganic hybrid perovskites is crucial in tuning the optoelectronic properties and improving the device performance.


2021 ◽  
Vol 91 ◽  
pp. 106077
Author(s):  
Faiza Jan Iftikhar ◽  
Qamar Wali ◽  
Shengyuan Yang ◽  
Yaseen Iqbal ◽  
Rajan Jose ◽  
...  

RSC Advances ◽  
2021 ◽  
Vol 11 (44) ◽  
pp. 27570-27582
Author(s):  
Sabir Ali Siddique ◽  
Muhammad Arshad ◽  
Sabiha Naveed ◽  
Muhammad Yasir Mehboob ◽  
Muhammad Adnan ◽  
...  

We used a quantum chemical approach to investigate the optoelectronic properties of dyes T1–T5 for dye-sensitized solar cells using DFT and TD-DFT computation. The newly designed molecules exhibited outstanding photovoltaic and optoelectronic properties.


2021 ◽  
Vol 10 (4) ◽  
pp. 489-502 ◽  
Author(s):  
M. Raftani ◽  
T. Abram ◽  
W. Loued ◽  
R. Kacimi ◽  
A. Azaid ◽  
...  

In the present paper, four π-conjugated materials, based on terphenyl and pyrrole, with A–D–A structure have been theoretically studied to propose new organic compounds to be used in the organic solar cell field. Moreover, the geometrical and optoelectronic properties of the designed molecules M1, M2, M3 and M4 have been computed after optimization in their fundamental states, using the quantum chemical method DFT / B3LYP/ 6−311G (d, p). Different parameters including HOMO and LUMO energy levels, bandgap energy, frontier molecular orbital (FMO), chemical reactivity indices, the density of states (DOS), Voc, electrostatic potential (ESP), and thermodynamic parameters at several temperatures in the range of 0-500 K have been determined. The absorption properties including the transition energy, the wavelengths (λmax), the excitation vertical energy, and the corresponding oscillator strengths of these molecules have been studied using the quantum chemical method TD−DFT / CAM–B3LYP / 6–311G (d, p). The obtained results of our studied compounds show that M3 (with 2H, 2'H-1, 1'-biisoindole moiety) as a donor group has special optoelectronic, absorption, and good photovoltaic characteristics. Thus, they can be utilized as an electron-donating in organic solar cells BHJ type.


2019 ◽  
Vol 76 (2) ◽  
pp. 179-183
Author(s):  
Kaoru UEGAKI ◽  
Kazuhiro NAKABAYASHI ◽  
Shin-ichi YAMAMOTO ◽  
Shotaro HAYASHI ◽  
Toshio KOIZUMI

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