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Title: New vanadium tellurites: Syntheses, structures, optical properties of noncentrosymmetric VTeO{sub 4}(OH), centrosymmetric Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10})

Abstract

Two new vanadium tellurites, VTeO{sub 4}(OH) (1) and Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10}) (2), have been synthesized successfully with the use of hydrothermal reactions. The crystal structures of the two compounds were determined by single-crystal X-ray diffraction. Compound 1 crystallizes in the polar space group Pca2{sub 1} (No. 29) while compound 2 crystallizes in the centrosymmetric space group C2/c (No. 15). The topography of compound 1 reveals a two-dimensional, layered structure comprised of VO{sub 6} octahedral chains and TeO{sub 3}(OH) zig-zag chains. Compound 2, on the contrary, features a three-dimensional [V{sub 4}O{sub 8}(Te{sub 3}O{sub 10})]{sup 4-} anionic framework with Ba{sup 2+} ions filled into the 10-member ring helical tunnels. The [V{sub 4}O{sub 8}(Te{sub 3}O{sub 10})]{sup 4-} anionic network is the first 3D vanadium tellurite framework to be discovered in the alkaline-earth vanadium tellurite system. Powder second harmonic generation (SHG) measurements indicate that compound 1 shows a weak SHG response of about 0.3×KDP (KH{sub 2}PO{sub 4}) under 1064 nm laser radiation. Infrared spectroscopy, elemental analysis, thermal analysis, and dipole moment calculations have also been carried out. - Graphical abstract: VTeO{sub 4}(OH) (1) crystallizes in the noncentrosymmetric space group Pca2{sub 1} (No. 29) while Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10}) (2)more » crystallizes in the centrosymmetric space group C2/c (No. 15). - Highlights: • VTeO{sub 4}(OH) (1) and Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10}) (2) have been synthesized successfully with the use of hydrothermal reactions. • VTeO{sub 4}(OH) (1) crystallizes in the noncentrosymmetric space group Pca2{sub 1} and displays a weak SHG response. • VTeO{sub 4}(OH) (1) represents only the fourth SHG-active material found in vanadium tellurite systems. • Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10}) (2) exhibits a novel three-dimensional [V{sub 4}O{sub 8}(Te{sub 3}O{sub 10})]{sup 4-} anionic framework.« less

Authors:
 [1];  [2];  [3];  [1];  [2];  [4];  [3];  [4];  [5]
  1. College of Chemistry, Fuzhou University, Fuzhou, Fujian 350108 (China)
  2. (China)
  3. Department of Chemistry and Biochemistry, Florida State University, Tallahassee, FL 32306 (United States)
  4. State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002 (China)
  5. (United States)
Publication Date:
OSTI Identifier:
22658255
Resource Type:
Journal Article
Resource Relation:
Journal Name: Journal of Solid State Chemistry; Journal Volume: 249; Other Information: Copyright (c) 2017 Elsevier Science B.V., Amsterdam, The Netherlands, All rights reserved.; Country of input: International Atomic Energy Agency (IAEA)
Country of Publication:
United States
Language:
English
Subject:
37 INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY; ABSORPTION SPECTROSCOPY; ANIONS; BARIUM COMPOUNDS; BARIUM IONS; EXPERIMENTAL DATA; HARMONIC GENERATION; HYDROTHERMAL SYNTHESIS; INFRARED SPECTRA; LASER RADIATION; MONOCLINIC LATTICES; OPTICAL PROPERTIES; ORTHORHOMBIC LATTICES; POTASSIUM PHOSPHATES; SPACE GROUPS; TELLURIUM COMPOUNDS; THERMAL ANALYSIS; VANADIUM COMPOUNDS; X-RAY DIFFRACTION

Citation Formats

Liang, Ming-Li, State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, Marsh, Matthew, Shang, Xian-Xing, State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, Mao, Jiang-Gao, Albrecht-Schmitt, Thomas E., Kong, Fang, E-mail: kongfang@fjirsm.ac.cn, and Department of Chemistry and Biochemistry, Florida State University, Tallahassee, FL 32306. New vanadium tellurites: Syntheses, structures, optical properties of noncentrosymmetric VTeO{sub 4}(OH), centrosymmetric Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10}). United States: N. p., 2017. Web. doi:10.1016/J.JSSC.2017.02.016.
Liang, Ming-Li, State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, Marsh, Matthew, Shang, Xian-Xing, State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, Mao, Jiang-Gao, Albrecht-Schmitt, Thomas E., Kong, Fang, E-mail: kongfang@fjirsm.ac.cn, & Department of Chemistry and Biochemistry, Florida State University, Tallahassee, FL 32306. New vanadium tellurites: Syntheses, structures, optical properties of noncentrosymmetric VTeO{sub 4}(OH), centrosymmetric Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10}). United States. doi:10.1016/J.JSSC.2017.02.016.
Liang, Ming-Li, State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, Marsh, Matthew, Shang, Xian-Xing, State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002, Mao, Jiang-Gao, Albrecht-Schmitt, Thomas E., Kong, Fang, E-mail: kongfang@fjirsm.ac.cn, and Department of Chemistry and Biochemistry, Florida State University, Tallahassee, FL 32306. Mon . "New vanadium tellurites: Syntheses, structures, optical properties of noncentrosymmetric VTeO{sub 4}(OH), centrosymmetric Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10})". United States. doi:10.1016/J.JSSC.2017.02.016.
@article{osti_22658255,
title = {New vanadium tellurites: Syntheses, structures, optical properties of noncentrosymmetric VTeO{sub 4}(OH), centrosymmetric Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10})},
author = {Liang, Ming-Li and State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002 and Marsh, Matthew and Shang, Xian-Xing and State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou 350002 and Mao, Jiang-Gao and Albrecht-Schmitt, Thomas E. and Kong, Fang, E-mail: kongfang@fjirsm.ac.cn and Department of Chemistry and Biochemistry, Florida State University, Tallahassee, FL 32306},
abstractNote = {Two new vanadium tellurites, VTeO{sub 4}(OH) (1) and Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10}) (2), have been synthesized successfully with the use of hydrothermal reactions. The crystal structures of the two compounds were determined by single-crystal X-ray diffraction. Compound 1 crystallizes in the polar space group Pca2{sub 1} (No. 29) while compound 2 crystallizes in the centrosymmetric space group C2/c (No. 15). The topography of compound 1 reveals a two-dimensional, layered structure comprised of VO{sub 6} octahedral chains and TeO{sub 3}(OH) zig-zag chains. Compound 2, on the contrary, features a three-dimensional [V{sub 4}O{sub 8}(Te{sub 3}O{sub 10})]{sup 4-} anionic framework with Ba{sup 2+} ions filled into the 10-member ring helical tunnels. The [V{sub 4}O{sub 8}(Te{sub 3}O{sub 10})]{sup 4-} anionic network is the first 3D vanadium tellurite framework to be discovered in the alkaline-earth vanadium tellurite system. Powder second harmonic generation (SHG) measurements indicate that compound 1 shows a weak SHG response of about 0.3×KDP (KH{sub 2}PO{sub 4}) under 1064 nm laser radiation. Infrared spectroscopy, elemental analysis, thermal analysis, and dipole moment calculations have also been carried out. - Graphical abstract: VTeO{sub 4}(OH) (1) crystallizes in the noncentrosymmetric space group Pca2{sub 1} (No. 29) while Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10}) (2) crystallizes in the centrosymmetric space group C2/c (No. 15). - Highlights: • VTeO{sub 4}(OH) (1) and Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10}) (2) have been synthesized successfully with the use of hydrothermal reactions. • VTeO{sub 4}(OH) (1) crystallizes in the noncentrosymmetric space group Pca2{sub 1} and displays a weak SHG response. • VTeO{sub 4}(OH) (1) represents only the fourth SHG-active material found in vanadium tellurite systems. • Ba{sub 2}V{sub 4}O{sub 8}(Te{sub 3}O{sub 10}) (2) exhibits a novel three-dimensional [V{sub 4}O{sub 8}(Te{sub 3}O{sub 10})]{sup 4-} anionic framework.},
doi = {10.1016/J.JSSC.2017.02.016},
journal = {Journal of Solid State Chemistry},
number = ,
volume = 249,
place = {United States},
year = {Mon May 15 00:00:00 EDT 2017},
month = {Mon May 15 00:00:00 EDT 2017}
}
  • Four new quaternary vanado-tellurites and vanadyl-selenites, namely, SrVTeO{sub 5}(OH)(1), Cd{sub 2}V{sub 2}Te{sub 2}O{sub 11}(2), Ca{sub 3}VSe{sub 4}O{sub 13}·H{sub 2}O(3) and Ba{sub 2}VSe{sub 3}O{sub 10}(4) have been synthesized and structurally characterized by single crystal X-ray diffraction. The oxidation state of vanadium is +5 in tellurites 1 and 2 and +4 in selenites 3 and 4. The structures of SrVTeO{sub 5}(OH)(1) and Cd{sub 2}V{sub 2}Te{sub 2}O{sub 11}(2) compounds consist of (VTeO{sub 5}(OH)){sup 2-} and (V{sub 2}Te{sub 2}O{sub 11}){sup 4-}anionic chains respectively, which are built from tetrahedral VO{sub 4} and disphenoidal TeO{sub 4} moieties. Similarly the structures of Ca{sub 3}VSe{sub 4}O{sub 13}·H{sub 2}O(3)more » and Ba{sub 2}VSe{sub 3}O{sub 10}(4) respectively contain (VSe{sub 2}O{sub 7}){sup 2-} and (VSe{sub 3}O{sub 10}){sup 4-} anionic chains, which are made up of octahedral VO{sub 6} and pyramidal SeO{sub 3} units. Compounds 1 and 3 have been characterized by thermogravimetric and infrared spectroscopic methods. Compounds 1 and 2 are wide band gap semiconductors. - Graphical abstract: Ca{sub 3}VSe{sub 4}O{sub 13}·H{sub 2}O and Ba{sub 2}VSe{sub 3}O{sub 10} compounds contain (VSe{sub 2}O{sub 7}){sup 2-} and (VSe{sub 3}O{sub 10}){sup 4-} chains. - Highlights: • Four new vanado-tellurites and vanadyl-selenites are synthesized. • Their structural features are different. • The vanado-tellurites are wide band gap semiconductors.« less
  • Two new vanadium tellurites, Cu(TATP)V{sub 2}TeO{sub 8}(1) and Cu(DPPZ)V{sub 2}Te{sub 2}O{sub 10}(2), (TATP=1,4,8,9-tetranitrogen-trisphene, DPPZ=dipyridophenazine) have been synthesized under hydrothermal conditions and structurally characterized by elemental analyses, IR, and single-crystal X-ray diffraction. Compound 1 features an interesting two-dimensional layer structure constructed by [V{sub 2}TeO{sub 8}]{sub n} double-chain-like ribbons linked by [Cu(TATP)]{sup 2+} bridges. Compound 2 consists of two types of chiral layers: one left-handed and the other right-handed, which lead to racemic solid-state compound. In each layer, there exist two types of inorganic helical chains (V{sub 4}Te{sub 4}O{sub 8}){sub n} and (Te{sub 2}O{sub 2}){sub n}, with same handedness. Two types ofmore » helical chains are linked by mu{sub 3}(O6) atoms to generate a V/Te/O inorganic anionic layer. The [Cu(DPPZ)]{sup 2+} cationic complex fragments are covalently bonded to the layer, projecting below and above the vanadium tellurites layer. - Graphical abstract: The changes of the size of the rigid aromatic chelate ligands may influence the structures of the V-Te-O framework.« less
  • The six compounds Ba{sub 2}GaMQ{sub 5} (M=Sb,Bi; Q=Se,Te) and Ba{sub 2}InSbQ{sub 5} (Q=Se,Te) have been synthesized for the first time. Ba{sub 2}GaMQ{sub 5} (M=Sb,Bi; Q=Se,Te) and Ba{sub 2}InSbTe{sub 5} crystallize in the centrosymmetric space group Pnma, while Ba{sub 2}InSbSe{sub 5} belongs to the noncentrosymmetric polar space group Cmc2{sub 1}. The structures of the six new compounds contain infinite {sup 1}{sub {infinity}}[MM'Q{sub 5}]{sub 4-} anionic chains built by MQ{sub 4} (M Prime =Ga,In) tetrahedra and heavily distorted M Prime Q{sub 6} (M Prime =Sb,Bi) octahedra. Ba{sub 2}InSbSe{sub 5} possesses a band gap of 1.92(5) eV and exhibits a weak powder secondmore » harmonic generation signal using the 2090 nm laser as fundamental wavelength. - Graphical abstract: Ba{sub 2}InSbSe{sub 5} contains infinite {sup 1}{sub {infinity}}[InSbSe{sub 5}]{sub 4-} chains which are built by corner-shared InSe{sub 4} tetrahedra chains and edge-shared SbSe{sub 6} octahedra chains connected through edge sharing . Highlights: Black-Right-Pointing-Pointer Ba{sub 2}GaMQ{sub 5} (M=Sb,Bi; Q=Se,Te) and Ba{sub 2}InSbQ{sub 5} (Q=Se,Te) have been synthesized. Black-Right-Pointing-Pointer The structures contain infinite {sup 1}{sub {infinity}}[MM'Q{sub 5}]{sub 4-} (M Prime =Ga,In) anionic chains. Black-Right-Pointing-Pointer The chains are built by distorted MQ{sub 6} (M=Sb,Bi) octahedra and M Prime Q{sub 4} (M Prime =Ga,In) tetrahedra. Black-Right-Pointing-Pointer Ba{sub 2}InSbSe{sub 5} exhibits a weak powder second harmonic generation signal.« less
  • Two new potassium vanadium phosphates have been prepared and their structures have been determined from analysis of single crystal X-ray data. The two compounds, K[sub 3](VO)(V[sub 2]O[sub 3])(PO[sub 4])[sub 2](HPO[sub 4]) and K[sub 3](VO)(HV[sub 2]O[sub 3])(PO[sub 4])[sub 2](HPO[sub 4]), are isostructural, except for the incorporation of an extra hydrogen atom into the nearly identical frameworks. The structures consist of a three-dimensional network of [VO][sub n] chains connected through phosphate groups to a [V[sub 2]O[sub 3]] moiety. Magnetic susceptibility experiments indicate that in the case of the di-hydrogen compound, there are no significant magnetic interactions between the three independent vanadium (IV)more » centers. Crystal data: for K[sub 3](VO)(V[sub 2]O[sub 3])(PO[sub 4])[sub 2] (HPO[sub 4]), M[sub r] = 620.02, orthorhombic space group Pnma (No. 62), a = 7.023(4) [angstrom], b = 13.309(7) [angstrom], c = 14.294(7) [angstrom], V = 1336(2) [angstrom][sup 3], Z = 4, R = 5.02%, and R[sub w] = 5.24% for 1238 observed reflections [I > 3[sigma](I)]; for K[sub 3](VO)(HV[sub 2]O[sub 3])(PO[sub 4])[sub 2](HPO[sub 4]), M[sub r] = 621.04, orthorhombic space group Pnma (No. 62), a = 6.975(3) [angstrom], b = 13.559(7) [angstrom], c = 14.130(7) [angstrom], V = 1336(1) [angstrom][sup 3], Z = 4, R = 6.02%, and R[sub w] = 6.34% for 1465 observed reflections [I > 3[sigma](I)].« less
  • Two new quaternary strontium selenium(IV) and tellurium(IV) oxychlorides, namely, Sr{sub 3}(SeO{sub 3})(Se{sub 2}O{sub 5})Cl{sub 2} and Sr{sub 4}(Te{sub 3}O{sub 8})Cl{sub 4}, have been prepared by solid-state reaction. Sr{sub 3}(SeO{sub 3})(Se{sub 2}O{sub 5})Cl{sub 2} features a three-dimensional (3D) network structure constructed from strontium(II) interconnected by Cl{sup -}, SeO{sub 3}{sup 2-} as well as Se{sub 2}O{sub 5}{sup 2-} anions. The structure of Sr{sub 4}(Te{sub 3}O{sub 8})Cl{sub 4} features a 3D network in which the strontium tellurium oxide slabs are interconnected by bridging Cl{sup -} anions. The diffuse reflectance spectrum measurements and results of the electronic band structure calculations indicate that both compoundsmore » are wide band-gap semiconductors. - Graphical abstract: Solid-state reactions of SrO, SrCl{sub 2}, and SeO{sub 2} or TeO{sub 2} in different molar ratios and under different temperatures lead to two new strontium selenium(IV) or tellurium(IV) oxychlorides with two different types of structures, namely, Sr{sub 3}(SeO{sub 3})(Se{sub 2}O{sub 5})Cl{sub 2} and Sr{sub 4}(Te{sub 3}O{sub 8})Cl{sub 4}. Both compounds are wide band-gap semiconductors based on the diffuse reflectance spectra and the electronic band structures.« less