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Two fullerene derivatives C-MP and C-ETPA were designed and synthesized for tin-halide perovskite solar cells. The introduction of an electron-withdrawing group and an alkyl chain reduced the electron affinity, resulting in a shallower lowest unoccupied molecular orbital (LUMO) energy level than that of common phenyl-C-butyric acid methyl ester (PCBM). Moreover, the smaller energy level offset provided efficient carrier transport and suppressed charge recombination. As a result, the devices with C-ETPA achieved an open-circuit voltage of 0.76 V and a power conversion efficiency of over 10%, which were substantially higher than 0.63 V and 8.25% for the control devices with PCBM, respectively.
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http://dx.doi.org/10.1039/d2cc05310a | DOI Listing |
Phys Chem Chem Phys
September 2025
School of Physics, Nanjing University of Science and Technology, Nanjing 210094, China.
Multifunctional materials that simultaneously possess intrinsic magnetic and superhard properties, particularly those composed of light elements, have a wide range of applications in advanced sensors, shielding, durable devices, and other fields. However, research on the development and understanding of such materials remains limited. In this study, a series of 3D C covalent networks derived from the C fullerene precursor were theoretically designed.
View Article and Find Full Text PDFRSC Adv
August 2025
Department of Chemistry, University of Agriculture Faisalabad 38000 Pakistan.
Traditional fullerene-based acceptors in organic solar cells (OSCs) suffer from limitations such as poor tunability, narrow absorption spectra, and limited morphological stability, restricting further improvements in device efficiency. To address these challenges, non-fullerene acceptors (NFAs) with tunable energy levels and broad optical absorption have gained increasing attention. In this study, seven novel phthalimide core-based donor-acceptor molecules (BPDM1-BPDM7) are computationally designed by modifying the terminal units of a reference molecule (BPDF).
View Article and Find Full Text PDFMolecules
August 2025
Key Laboratory of Polymer Chemistry and Physics of Ministry of Education, School of Materials Science and Engineering, Peking University, Beijing 100871, China.
A series of novel discotic liquid crystalline donor-acceptor hybrid heterojunctions were prepared by blending the triphenylene derivative (T5E36) as donor and perylene tetracarboxylic esters as acceptor. Mesophases of blends were characterized by using polarized optical microscopy, differential scanning calorimetry, and X-ray diffraction. Results suggest that all the blends formed liquid crystalline phases, where both compounds in the blends self-assembled separately into columns yet cooperatively contributed to the overall hexagonal or tetragonal columnar mesophase structure.
View Article and Find Full Text PDFJ Chem Phys
August 2025
National Institute of Chemical Physics and Biophysics, Tallinn 12618, Estonia.
We used terahertz spectroscopy to study the non-covalent interaction between CH4 and the confining fullerene cage in endofullerene CH4@C60. The temperature dependence of the THz absorption spectra of powdered CH4@C60 was measured between 5 and 300 K. At temperatures below 50 K, the THz spectrum of CH4 shows a single line centered at 214 cm-1, which broadens and shifts to a higher energy as the temperature increases.
View Article and Find Full Text PDFJ Fluoresc
August 2025
Department of Chemistry, Quaid-i-Azam University Islamabad, Islamabad, Pakistan.
Perovskite solar cells (PSCs) are highly efficient and flexible; thus, they have garnered a lot of focus. In the past, many fullerene compounds, such as PCBM, were employed as electron transport layers in PSCs. PCBM has several drawbacks, including surface trapping states, limited electron mobility, poor photochemical as well as thermal stability, a low open-circuit voltage, and significant recombination losses.
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