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题名: Preparation, Structure, and Second-order Nonlinear Optical Properties of a Borate-Carboxylic Acid Compound: NH4B[D-(+)-C4H4O5](2)center dot H2O
作者: Chen, Zhaohui; Pan, Shilie; Jing, Qun; Yang, Yun; Dong, Xiaoyu; Bian, Qiang; Han, Jian; Dong, Lingyun; Yang, Zhihua
关键词: Crystal structure ; Crystal growth ; Organic-inorganic hybrid ; Nonlinear optical materials
刊名: ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE
发表日期: 2014
DOI: 10.1002/zaac.201300202
卷: 640, 期:1, 页:140-146
收录类别: SCI
摘要: The organic-inorganic hybrid nonlinear optical (NLO) material NH4B(d-(+)-C4H4O5)(2)H2O (NBC) was synthesized in a borate-carboxylic acid system. Its structure was determined by single crystal X-ray diffraction. It crystallizes in the orthorhombic system, space group Pna2(1) (No. 33), with cell parameters a = 11.484(6) angstrom, b = 5.354(3) angstrom, c = 21.079(12) angstrom, V = 1296.0(12), Z = 4. It exhibits a three-dimensional pseudo tunnel structure consisting of fundamental building block [B(d-(+)-C4H4O5)(2)](-) anions. The small cavities are occupied by the H2O molecules and NH4+ cations, which stabilize the whole structure by O-HO and N-HO hydrogen bonds. The powder X-ray diffraction (PXRD) of the crystal was also recorded. Elemental analyses, FT-IR and FT-Raman spectra analyses, thermal analysis, and diffuse-reflectance spectra for the compound are also presented, as are band structures and density of states calculation. Nonlinear optical measurements indicate that the material has second harmonic generation (SHG) properties and is phase-matchable.
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内容类型: 期刊论文
URI标识: http://ir.xjipc.cas.cn/handle/365002/3839
Appears in Collections:中国科学院特殊环境功能材料与器件重点试验室_期刊论文

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作者单位: Chinese Acad Sci, Xinjiang Tech Inst Phys & Chem, Xinjiang Key Lab Elect Informat Mat & Devices, Key Lab Funct Mat & Devices Special Environm, Urumqi 830011, Peoples R China;Xinjiang Univ, Phys & Chem Testing Ctr, Urumqi 830046, Peoples R China;Univ Chinese Acad Sci, Beijing 100049, Peoples R China

Recommended Citation:
Chen, Zhaohui,Pan, Shilie,Jing, Qun,et al. Preparation, Structure, and Second-order Nonlinear Optical Properties of a Borate-Carboxylic Acid Compound: NH4B[D-(+)-C4H4O5](2)center dot H2O[J]. ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE,2014,640(1):140-146.
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文件名: Preparation, Structure, and Second-order Nonlinear Optical Properties of a Borate-Carboxylic Acid Compound NH4B[D-(+)-C4H4O5](2)center dot H2O.pdf
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