Exploration of a new compound in the M-B-O-X (M: alkali metals; X: halogen) system: Preparation, crystal and electronic structures, and optical properties of Na3B6O10Br
Chen Zhaohui; Pan Shilie; Dong Xiaoyu; Yang Zhihua; Zhang Min; Su Xin
2013
Source PublicationINORGANICA CHIMICA ACTA
ISSN0020-1693
Volume406Issue:9Pages:205-210
Abstract

A new bromoborate Na3B6O10Br has been synthesized by the high temperature solution method. It crystallizes in orthorhombic space group Pnma (No. 53) with lattice constants a = 12.780(8) angstrom, b = 9.914(6) angstrom, c = 7.518(2) angstrom, Z = 4. The crystal structure contains an infinite three-dimensional matrix that is built from B6O13 units, Na(1)O4Br2, Na(2)O6Br, and Na(3)O-6 polyhedra. Interestingly, four B6O13 units are interconnected by oxygen atoms forming hexadecagon huge pores. IR spectrum, UV-Vis-NIR diffuse reflectance spectrum, and thermogravimetric analyses for the compound are also presented, as are band structures and density of states calculations.

KeywordNa3b6o10br Synthesis Crystal And Electronic Structures Borate
Subject AreaChemistry
DOI10.1016/j.ica.2013.04.046
Indexed BySCI
WOS IDWOS:000324325200028
Citation statistics
Cited Times:7[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Identifierhttp://ir.xjipc.cas.cn/handle/365002/2639
Collection新疆维吾尔自治区电子信息材料与器件重点实验室
材料物理与化学研究室
Corresponding AuthorPan Shilie
Affiliation1.Chinese Acad Sci, Xinjiang Key Lab Elect Informat Mat & Devices, Xinjiang Tech Inst Phys & Chem, Key Lab Funct Mat & Devices Special Environm, Urumqi 830011, Peoples R China
2.Xinjiang Univ, Phys & Chem Testing Ctr, Urumqi 830046, Peoples R China
3.Univ Chinese Acad Sci, Beijing 100049, Peoples R China
Recommended Citation
GB/T 7714
Chen Zhaohui,Pan Shilie,Dong Xiaoyu,et al. Exploration of a new compound in the M-B-O-X (M: alkali metals; X: halogen) system: Preparation, crystal and electronic structures, and optical properties of Na3B6O10Br[J]. INORGANICA CHIMICA ACTA,2013,406(9):205-210.
APA Chen Zhaohui,Pan Shilie,Dong Xiaoyu,Yang Zhihua,Zhang Min,&Su Xin.(2013).Exploration of a new compound in the M-B-O-X (M: alkali metals; X: halogen) system: Preparation, crystal and electronic structures, and optical properties of Na3B6O10Br.INORGANICA CHIMICA ACTA,406(9),205-210.
MLA Chen Zhaohui,et al."Exploration of a new compound in the M-B-O-X (M: alkali metals; X: halogen) system: Preparation, crystal and electronic structures, and optical properties of Na3B6O10Br".INORGANICA CHIMICA ACTA 406.9(2013):205-210.
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