Insight into a concentration-sensitive red-emitting phosphor Li2Ca4Si4O13:Eu3+ for multifunctional applications: Crystal structure, electronic structure and luminescent properties

2020 ◽  
Vol 46 (3) ◽  
pp. 2845-2852 ◽  
Author(s):  
Quansheng Wu ◽  
Quan Zhao ◽  
Penghui Zheng ◽  
Wenbo Chen ◽  
Dongfeng Xiang ◽  
...  
CrystEngComm ◽  
2014 ◽  
Vol 16 (33) ◽  
pp. 7621-7625 ◽  
Author(s):  
Cody J. Gleason ◽  
Jordan M. Cox ◽  
Ian M. Walton ◽  
Jason B. Benedict

Single crystal structures, luminescent properties and electronic structure calculations of three polymorphs of the opto-electronic charge transport material 4,4′-bis(9-carbazolyl)biphenyl.


2021 ◽  
Vol 0 (0) ◽  
Author(s):  
Olha Zhak ◽  
Oksana Karychort ◽  
Volodymyr Babizhetskyy ◽  
Chong Zheng

Abstract The title compound was prepared from the pure elements by sintering. The crystal structure was investigated by means of powder X-ray diffraction data. Ho5Pd19P12 exhibits the hexagonal Ho5Ni19P12-type structure with space group P 6 ‾ 2 m $P‾{6}2m$ , a = 13.1342(2), c = 3.9839(1) Å, R I = 0.060, R p = 0.080. The crystal structure can be described as a combination of two types of the structural units, [HoPd6P3] and [Ho3Pd10P6], respectively, mutually displaced by 1/2 along the crystallographic c axis. Quantum chemical calculations have been performed to analyze the electronic structure and provide deeper insight into the structure-property relationships. The results of the quantum chemical calculations indicate that the material features metallic bonding between Ho and Pd and covalent bonding between Pd and P.


2019 ◽  
Vol 269 ◽  
pp. 125-131 ◽  
Author(s):  
Dan Zhao ◽  
Ji Zhao ◽  
Ya-Li Xue ◽  
Bao-Fu Hu ◽  
Xia Xin ◽  
...  

2017 ◽  
Vol 685 ◽  
pp. 177-184 ◽  
Author(s):  
Zhi Xie ◽  
Weiwei Zhou ◽  
Wang Zhao ◽  
Hao Zhang ◽  
Qichang Hu ◽  
...  

2015 ◽  
Vol 22 (6) ◽  
pp. 1450-1458 ◽  
Author(s):  
D. K. Bora ◽  
X. Cheng ◽  
M. Kapilashrami ◽  
P. A. Glans ◽  
Y. Luo ◽  
...  

The electronic structure of a material plays an important role in its functionality for different applications which can be probed using synchrotron-based spectroscopy techniques. Here, various cobalt-based compounds, differing in crystal structure, ligands surrounding the central metal ion and morphology, have been studied by soft X-ray absorption spectroscopy (XAS) at the CoL-edge in order to measure the effect of these parameters on the electronic structure. A careful qualitative analysis of the spectral branching ratio and relative intensities of theL3andL2peaks provide useful insight into the electronic properties of compounds such as CoO/Co(OH)2, CoCl2.6H2O/CoF2.4H2O, CoCl2/CoF2, Co3O4(bulk/nano/micro). For further detailed analysis of the XAS spectra, quantitative analysis has been performed by fitting the spectral profile with simulated spectra for a number of cobalt compounds using crystal field atomic multiplet calculations.


2017 ◽  
Vol 73 (9) ◽  
pp. 1298-1301 ◽  
Author(s):  
Trevor R. Nason ◽  
Melbourne J. Schriver ◽  
Arthur D. Hendsbee ◽  
Jason D. Masuda

The title compound, C10H7NO2S, provides the first structure of an α-alkenyl oxathiazolone ring. The phenyl ring and the oxathiazolone groups make dihedral angles of 0.3 (3) and −2.8 (3)°, respectively, with the plane of the central alkene group; the dihedral angle between the rings is 2.68 (8)°. A careful consideration of bond lengths provides insight into the electronic structure and reactivity of the title compound. In the crystal, extended π-stacking is observed parallel to thea-axis direction, consisting of cofacial head-to-tail dimeric units [centroid–centroid distance of 3.6191 (11) Å]. These dimeric units are separated by a slightly longer centroid–centroid distance of 3.8383 (12) Å, generating infinite stacks of molecules.


RSC Advances ◽  
2016 ◽  
Vol 6 (73) ◽  
pp. 68852-68859 ◽  
Author(s):  
Yaling Zheng ◽  
Weidong Zhuang ◽  
Xianran Xing ◽  
Jiyou Zhong ◽  
Ronghui Liu ◽  
...  

Phosphor Ca2LuZrScAl2GeO12:Ce is synthesized. Crystal structure, electronic structure and luminescence property of samples are investigated. Electronic structure study indicates that photo-ionization easy occur when the matrix contains Ge4+ or Zr4+.


2018 ◽  
Vol 32 (34n36) ◽  
pp. 1840063 ◽  
Author(s):  
Dandan Zhang ◽  
Huaxing Xiao ◽  
Wei Jiang ◽  
Xia Cao ◽  
Lu Huang ◽  
...  

Ba[Formula: see text](PO4)2:0.04Eu[Formula: see text] (S1) and Ba[Formula: see text]Na[Formula: see text](PO4)2:0.04Eu[Formula: see text] (S2) were prepared by solid state reaction. The phases and luminescent properties of the obtained phosphors were characterized. The results demonstrate that the phosphors particles emit an intensive red light under excitation at 395 nm. Both phosphors can be efficiently excited by ultraviolet and blue light, and the emission spectra mainly consist of two emission peaks at 591 nm and 611 nm. The crystallographic sites of Eu[Formula: see text] ions in Ba3(PO4)2 host were discussed on the base of emission spectra and its host crystal structure. By introducing the charge compensator Na[Formula: see text] into the S1 phosphor, its emission intensity was enhanced, indicating that S2 could serve as a promising red-emitting phosphor for UV LED applications.


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