Kumar Manoj, Khatri Savita, Kumar Vipin, Ahlawat Pratibha, Singh Sonika, Kaushik Mukesh Kumar, Khatkar S P, Taxak V B, Kumar Rajesh
University Institute of Engineering and Technology, Maharshi Dayanand University, Rohtak, 124001, India.
Department of Chemistry, Chaudhary Bansi Lal University, Bhiwani, 127021, India.
J Fluoresc. 2024 Jan;34(1):227-244. doi: 10.1007/s10895-023-03263-7. Epub 2023 May 17.
Highly emissive ternary Eu(III) complexes were synthesized with a tri-fluorinated β-diketone as principal ligand and heterocyclic aromatic compounds as ancillary ligands to assess their utility as an illuminating material for display devices and other optoelectronics. The general characterizations, regarding the coordinating facets of complexes were accomplished via various spectroscopic techniques. Thermal stability was investigated via TGA/DTA. Photophysical analysis was accomplished by PL studies, Band gap value, color parameters and J-O analysis. DFT calculations were performed adopting geometrically optimized structure of complexes. Superb thermal stability has been achieved in complexes, which decides their concrete candidature for display devices. The bright red luminescence of complexes is ascribed to D → F transition of Eu(III) ion. Colorimetric parameters unlocked the applicability of complexes as warm light source and J-O parameters adequately summarized the coordinating surrounding around the metal ion. Various radiative properties were also evaluated which suggested the prospective use of complexes in lasers and other optoelectronic devices. The band gap and Urbach band tail, procured from absorption spectra, revealed the semiconducting behavior of synthesized complexes. DFT studies rendered the energies of FMO and various other molecular parameters. It can be summarized from the photophysical and optical analysis of synthesized complexes that these complexes are virtuous luminescent materials and possess potentiality to be used in diverse domain of display devices.
合成了以三氟代β-二酮为主配体、杂环芳香化合物为辅助配体的高发射三元铕(III)配合物,以评估它们作为显示设备和其他光电器件照明材料的效用。通过各种光谱技术对配合物的配位方面进行了一般表征。通过热重分析/差示热分析研究了热稳定性。通过光致发光研究、带隙值、颜色参数和J-O分析完成了光物理分析。采用配合物的几何优化结构进行了密度泛函理论计算。配合物具有出色的热稳定性,这决定了它们在显示设备中的具体适用性。配合物的亮红色发光归因于铕(III)离子的D→F跃迁。比色参数揭示了配合物作为暖光源的适用性,J-O参数充分总结了金属离子周围的配位环境。还评估了各种辐射性质,这表明配合物在激光和其他光电器件中的潜在用途。从吸收光谱获得的带隙和乌尔巴赫带尾揭示了合成配合物的半导体行为。密度泛函理论研究给出了前线分子轨道的能量和各种其他分子参数。从合成配合物的光物理和光学分析可以总结出,这些配合物是优良的发光材料,具有在显示设备的不同领域中使用的潜力。