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Small · 2024 ·Vol. 20 ·期 29 ·2310563 · IF 13

Formation and Fluorescent Mechanism of Multiple Color Emissive Carbon Dots from o-Phenylenediamine

Pengfei Li,Shanshan Xue,Lu Sun,Xiaobao Ma,Wenning Liu,Li An,Yichang Liu,Dan Qu,Zaicheng Sun

Carbon dots (CDs) have received considerable attention in many application areas owing to their unique optical properties and potential applications; however, the fluorescent mechanism is an obstacle to their applications. Herein, three-color emissive CDs are prepared from single o -phenylenediamine (oPD) by regulating the ratio of ethanol and dimethylformamide (DMF). Fluorescent mechanism of these CDs is proposed as molecular state fluorescence. Reaction intermediates are identified using liquid chromatrography–mass spectroscopy (LC–MS) and 1 H nuclear magnetic resonance (NMR) spectra. 1H-Benzo[d]imidazole (BI), 2,3-diaminophenazine (DAP), and 5,14-dihydroquinoxalino[2,3-b] phenazine (DHQP) are proposed to be the fluorophores of blue, green, and red emissive CDs by comparing their optical properties. As per the LC–MS and 1 H-NMR analysis, DHQP with red emission tends to form from DAP and oPD in pure ethanol. By adding DMF, BI formation is enhanced and DHQP formation is suppressed. The prepared CDs exhibit green emission with DAP. When the DMF amount is >50%, BI formation is considerably promoted, resulting in DAP formation being suppressed. BI with blue emission then turns into the fluorophore of CDs. This result provides us an improved understanding of the fluorescent mechanism of oPD-based CDs, which guides us in designing the structure and optical properties of CDs.

CAS / MDL: 68-12-2
研究领域: 材料科学 · 光学 · 化学
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JOURNAL OF MOLECULAR STRUCTURE · 2025 · IF 4.7

Synthesis, characterization and theoretical calculations of a new rare-earth fluoride with a DUV cutoff edge

Xiaotian Ma,Shaohua Liu,Xifa Long,Yun Yang

A new mixed alkali metal and rare-earth metal fluoride, Rb 2 Sc 3 F 11 , was successfully synthesized using the high-temperature solution method. It is a rare example containing mixed ScF 7 and ScF 6 groups and crystallizes in the orthorhombic space group Imma (No. 74). Significantly, the optical characterization indicates that Rb 2 Sc 3 F 11 shows a short deep-ultraviolet (DUV) cutoff edge (<200 nm) due to the introduction of the rare-earth scandium and the fluorine with the large electronegativity. It also possesses a moderate birefringence (0.037@532 nm). First-principles calculations were also implemented for a better understanding of the relationship between structure with properties of Rb 2 Sc 3 F 11 .

CAS / MDL: 13446-74-7
研究领域: 材料科学 · 理论化学
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