Structure, Raman and infrared spectroscopic properties of new nonlinear optical material Na3VO2B6O11

doi:10.1016/j.molstruc.2016.03.086

	Structure, Raman and infrared spectroscopic properties of new nonlinear optical material Na3VO2B6O11
	Zhang, Ji 1; Dou, Renqin2 ; Zhang, Deming2 ; Zhang, Qingli2 ; Yin, Shaotang 2
	2016-08-15
发表期刊	JOURNAL OF MOLECULAR STRUCTURE
摘要	In this paper we report on the structure of Na3VO2B6O11 (NVBO) single crystals which were investigated by XRD, polarized Raman spectra in the range from 10 to 1600 cm(-1) and infrared spectrum (IR) in the range from 100 to 1600 cm(-1). Factor group analysis has been used to study the full vibrational representation of the crystal. More than 120 phonon modes have been obtained, which are related to B-O and V-O vibration in the trigonal planar BO3 triangle groups and tetrahedral BO4/VO4 groups. The high frequency bands located at 1300-1415 cm(-1) are assigned to stretching modes of the trigonal planar BO3 groups. Moreover, intense Raman modes located at 631 cm(-1) is related to BO3 bending vibration as well. The weak band at 1158 cm(-1) (A(1) mode) and strong band at 431 cm(-1) (A(1) mode) are attributed to asymmetric stretching and bending vibration mode of tetrahedral BO4 groups respectively. The vibrational band at 765-738 cm(-1) in the Raman spectra of NVBO crystal maybe related to the breathing vibration of the boroxol ring consisting of two BO4 tetrahedra. In addition, we assigned the intense band 900 (A(1) mode) and 831 cm(-1) (132 mode) are relative to the v(1) symmetric stretching vibration of VO4 tetrahedra. And the middle intense band at 382 (A(1) mode) and 385 (A(2) mode) are due to O-V-O vibration in VO4 tetrahedra. (C) 2016 Published by Elsevier B.V.
文章类型	Article
关键词	Na3vo2b6o11 Crystal Raman Spectra Ir Spectra Phonon
WOS标题词	Science & Technology ; Physical Sciences
DOI	10.1016/j.molstruc.2016.03.086
关键词[WOS]	CRYSTAL-STRUCTURE ; GLASSES ; SPECTRA ; LI2B4O7 ; LIB3O5 ; GROWTH ; IR
收录类别	SCI
语种	英语
项目资助者	Natural Science Foundation of China(51302268 ; Natural Science Foundation of China(51302268 ; Natural Science Foundation of China(51302268 ; Natural Science Foundation of China(51302268 ; Natural Science Foundation of China(51302268 ; Natural Science Foundation of China(51302268 ; Natural Science Foundation of China(51302268 ; Natural Science Foundation of China(51302268 ; Natural Science Foundation of Anhui Province(KJ2015A339) ; Natural Science Foundation of Anhui Province(KJ2015A339) ; Natural Science Foundation of Anhui Province(KJ2015A339) ; Natural Science Foundation of Anhui Province(KJ2015A339) ; Natural Science Foundation of Anhui Province(KJ2015A339) ; Natural Science Foundation of Anhui Province(KJ2015A339) ; Natural Science Foundation of Anhui Province(KJ2015A339) ; Natural Science Foundation of Anhui Province(KJ2015A339) ; 51102239) ; 51102239) ; 51102239) ; 51102239) ; 51102239) ; 51102239) ; 51102239) ; 51102239)
WOS研究方向	Chemistry
WOS类目	Chemistry, Physical
WOS记录号	WOS:000377828700048
引用统计	被引频次：5[WOS] [WOS记录] [WOS相关记录]
文献类型	期刊论文
条目标识符	http://ir.hfcas.ac.cn:8080/handle/334002/30871
专题	中科院安徽光学精密机械研究所
作者单位	1.Anhui Xin Hua Univ, Hefei 230088, Peoples R China 2.Chinese Acad Sci, Anhui Inst Opt & Fine Mech, Hefei 230031, Peoples R China
推荐引用方式 GB/T 7714	Zhang, Ji,Dou, Renqin,Zhang, Deming,et al. Structure, Raman and infrared spectroscopic properties of new nonlinear optical material Na3VO2B6O11[J]. JOURNAL OF MOLECULAR STRUCTURE,2016,1118(无):378-382.
APA	Zhang, Ji,Dou, Renqin,Zhang, Deming,Zhang, Qingli,&Yin, Shaotang.(2016).Structure, Raman and infrared spectroscopic properties of new nonlinear optical material Na3VO2B6O11.JOURNAL OF MOLECULAR STRUCTURE,1118(无),378-382.
MLA	Zhang, Ji,et al."Structure, Raman and infrared spectroscopic properties of new nonlinear optical material Na3VO2B6O11".JOURNAL OF MOLECULAR STRUCTURE 1118.无(2016):378-382.

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