Synthesis, crystal structure, optical properties and theoretical calculations of a new potassium lead pentaborate, KPbB5O9
Zhou Lin; Pan Shilie; Su Xin; Yang Zhihua; Wu Hongping; Yu Hongwei; Zhang Fangfang; Cui Sifang; Zhou Zhongxiang
2013
发表期刊JOURNAL OF MOLECULAR STRUCTURE
ISSN0022-2860
卷号1049期号:10页码:473-478
摘要

A new potassium lead pentaborate compound, KPbB5O9 has been synthesized by standard solid-state reaction for the first time. Its structure has been determined by single-crystal X-ray diffraction method. It crystallizes in the monoclinic space group P2(1)/c with lattice constants a = 6.717(3) angstrom, b = 8.389(3) angstrom, c = 13.686(5) angstrom, beta = 94.679(4)degrees and Z = 4. The structure consists of double ring B5O9 units, KO8 and PbO6 polyhedra. The PbO6 polyhedra linked together via corner-sharing O atom forming novel infinite (infinity)[PbO6] chains along the b axis. Thermal analyses, IR spectroscopy and UV-vis-NIR diffuse reflectance spectrum, and band structure calculation were performed.

关键词Kpbb5o9 Synthesis Crystal Structure Theoretical Calculations
学科领域Chemistry
DOI10.1016/j.molstruc.2013.06.071
收录类别SCI
WOS记录号WOS:000324784700059
引用统计
文献类型期刊论文
条目标识符http://ir.xjipc.cas.cn/handle/365002/2631
专题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
通讯作者Pan Shilie
作者单位1.Xinjiang Tech Inst Phys & Chem, Key Lab Funct Mat & Devices Special Environm, CAS, Xinjiang Key Lab Elect Informat Mat & Devices, Urumqi 830011, Peoples R China
2.Univ Chinese Acad Sci, Beijing 100039, Peoples R China
3.Huazhong Univ Sci & Technol, Sch Opt & Elect Informat, Wuhan 430074, Peoples R China
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Zhou Lin,Pan Shilie,Su Xin,et al. Synthesis, crystal structure, optical properties and theoretical calculations of a new potassium lead pentaborate, KPbB5O9[J]. JOURNAL OF MOLECULAR STRUCTURE,2013,1049(10):473-478.
APA Zhou Lin.,Pan Shilie.,Su Xin.,Yang Zhihua.,Wu Hongping.,...&Zhou Zhongxiang.(2013).Synthesis, crystal structure, optical properties and theoretical calculations of a new potassium lead pentaborate, KPbB5O9.JOURNAL OF MOLECULAR STRUCTURE,1049(10),473-478.
MLA Zhou Lin,et al."Synthesis, crystal structure, optical properties and theoretical calculations of a new potassium lead pentaborate, KPbB5O9".JOURNAL OF MOLECULAR STRUCTURE 1049.10(2013):473-478.
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