Two halide-containing cesium manganese vanadates: synthesis, characterization, and magnetic properties

Smith Pellizzeri, Tiffany M.; McGuire, Michael A.; McMillen, Colin D.; Wen, Yimei; Chumanov, George; Kolis, Joseph W.

doi:10.1039/c7dt04642a

Title: Two halide-containing cesium manganese vanadates: synthesis, characterization, and magnetic properties

Journal Article · Wed Jan 24 00:00:00 EST 2018 · Dalton Transactions

DOI:https://doi.org/10.1039/c7dt04642a· OSTI ID:1422572

Smith Pellizzeri, Tiffany M. ^[1];

^[2];

^[1]; Wen, Yimei ^[1]; Chumanov, George ^[1]; Kolis, Joseph W. ^[1]

Clemson Univ., SC (United States). Department of Chemistry and Center for Optical Materials Science and Engineering Technologies (COMSET)
Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States). Materials Science and Technology Division

In this study, two new halide-containing cesium manganese vanadates have been synthesized by a high-temperature (580 °C) hydrothermal synthetic method from aqueous brine solutions. One compound, Cs₃Mn(VO₃)₄Cl, (1) was prepared using a mixed cesium hydroxide/chloride mineralizer, and crystallizes in the polar noncentrosymmetric space group Cmm2, with a = 16.7820(8) Å, b = 8.4765(4) Å, c = 5.7867(3) Å. This structure is built from sinusoidal zig-zag (VO₃)_n chains that run along the b-axis and are coordinated to Mn²⁺ containing (MnO₄Cl) square-pyramidal units that are linked together to form layers. The cesium cations reside between the layers, but also coordinate to the chloride ion, forming a cesium chloride chain that also propagates along the b-axis. The other compound, Cs₂Mn(VO₃)₃F, (2) crystallizes in space group Pbca with a = 7.4286(2) Å, b = 15.0175(5) Å, c = 19.6957(7) Å, and was prepared using a cesium fluoride mineralizer. The structure is comprised of corner sharing octahedral Mn²⁺ chains, with trans fluoride ligands acting as bridging units, whose ends are capped by (VO₃)_n vanadate chains to form slabs. The cesium atoms reside between the manganese vanadate layers, and also play an integral part in the structure, forming a cesium fluoride chain that runs along the b-axis. Both compounds were characterized by single-crystal X-ray diffraction, powder X-ray diffraction, and single-crystal Raman spectroscopy. Additionally, the magnetic properties of 2 were investigated. Lastly, above 50 K, it displays behavior typical of a low dimensional system with antiferromagnetic interactions, as to be expected for linear chains of manganese(II) within the crystal structure.

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Research Organization:: Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22). Materials Sciences & Engineering Division

Grant/Contract Number:: AC05-00OR22725

OSTI ID:: 1422572

Journal Information:: Dalton Transactions, Vol. 47, Issue 8; ISSN 1477-9226

Publisher:: Royal Society of ChemistryCopyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 8 works

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References (47)

Syntheses and Characterization of a Family of Vanadate Compounds Ba ₃ M(V ₂ O ₇ ) ₂ (M = Co, Mn, Mg, or Zn) with an Edge-Shared [M ₂ O ₁₀ ] Dimer Structure Wang, Nannan; He, Zhangzhen; Cui, Meiyan Crystal Growth & Design, Vol. 15, Issue 4 https://doi.org/10.1021/cg5012814	journal	March 2015
Synthesis and Characterization of the Crystal Structure and Magnetic Properties of the Ternary Manganese Vanadate NaMnVO ₄ Ben Yahia, Hamdi; Gaudin, Etienne; Boulahya, Khalid Inorganic Chemistry, Vol. 49, Issue 18 https://doi.org/10.1021/ic101180h	journal	September 2010
Strontium manganese vanadates from hydrothermal brines: Synthesis and structure of Sr2Mn2(V3O10)(VO4), Sr3Mn(V2O7)2, and Sr2Mn(VO4)2(OH) Smith Pellizzeri, Tiffany M.; McMillen, Colin D.; Pellizzeri, Steven Journal of Solid State Chemistry, Vol. 255 https://doi.org/10.1016/j.jssc.2017.07.008	journal	November 2017
Frustrated magnetism in the S = 1 kagomé lattice BaNi3(OH)2(VO4)2 Freedman, Danna E.; Chisnell, Robin; McQueen, Tyrel M. Chem. Commun., Vol. 48, Issue 1 https://doi.org/10.1039/C1CC14731E	journal	January 2012
Hydrothermal Synthesis and Characterization of Novel Brackebuschite-Type Transition Metal Vanadates: Ba ₂ M(VO ₄ ) ₂ (OH), M = V ³⁺ , Mn ³⁺ , and Fe ³⁺ , with Interesting Jahn–Teller and Spin-Liquid Behavior Sanjeewa, Liurukara D.; McGuire, Michael A.; Garlea, Vasile O. Inorganic Chemistry, Vol. 54, Issue 14 https://doi.org/10.1021/acs.inorgchem.5b01037	journal	July 2015
Multidimensional Open-Frameworks: Combinations of One-Dimensional Channels and Two-Dimensional Layers in Novel Bi/M Oxo-Chlorides Lü, Minfeng; Aliev, Almaz; Olchowka, Jacob Inorganic Chemistry, Vol. 53, Issue 1 https://doi.org/10.1021/ic402578m	journal	December 2013
Magnetic and structural phase transitions of multiferroic boracites $M_{3} B_{7} O_{13} X$ ( $M = 3 d$ transition metal Cr–Zn or Mg; $X = halogen Cl$ , Br, I) Schnelle, Walter; Schmid, Hans Physical Review B, Vol. 91, Issue 18 https://doi.org/10.1103/PhysRevB.91.184411	journal	May 2015
Three Unique Barium Manganese Vanadates from High-Temperature Hydrothermal Brines Smith Pellizzeri, Tiffany M.; McMillen, Colin D.; Wen, Yimei Inorganic Chemistry, Vol. 56, Issue 7 https://doi.org/10.1021/acs.inorgchem.7b00229	journal	March 2017
Crystal Structure of Cs2V4O11with Unusual V–O Coordinations Oka, Yoshio; Saito, Fumihiko; Yao, Takeshi Journal of Solid State Chemistry, Vol. 134, Issue 1 https://doi.org/10.1006/jssc.1997.7533	journal	November 1997
Synthesis of polyoxovanadates via “chimie douce” Livage, Jacques Coordination Chemistry Reviews, Vol. 178-180 https://doi.org/10.1016/S0010-8545(98)00105-2	journal	December 1998
A Synthetic Route toward Layered Materials: Introducing Stereochemically Active Lone-Pairs into Transition Metal Oxohalides Zimmermann, Iwan; Johnsson, Mats Crystal Growth & Design, Vol. 14, Issue 10 https://doi.org/10.1021/cg5010374	journal	September 2014
Fluoride-Rich, Hydrofluorothermal Routes to Functional Transition Metal (Mn, Fe, Co, Cu) Fluorophosphates Armstrong, Jennifer A.; Williams, Edward R.; Weller, Mark T. Journal of the American Chemical Society, Vol. 133, Issue 21 https://doi.org/10.1021/ja201096b	journal	June 2011
Polar Materials with Isolated V ⁴⁺ S = 1/2 Triangles: NaSr ₂ V ₃ O ₃ (Ge ₄ O ₁₃ )Cl and KSr ₂ V ₃ O ₃ (Ge ₄ O ₁₃ )Cl Sanjeewa, Liurukara D.; McGuire, Michael A.; McMillen, Colin D. Chemistry of Materials, Vol. 29, Issue 3 https://doi.org/10.1021/acs.chemmater.6b05320	journal	January 2017
Flux Synthesis, Crystal Structures, and Luminescence Properties of Salt-Inclusion Lanthanide Silicates: [K ₉ F ₂ ][Ln ₃ Si ₁₂ O ₃₂ ] (Ln = Sm, Eu, Gd) Tang, Ming-Feng; Chiang, Pei-Yun; Su, Yu-Han Inorganic Chemistry, Vol. 47, Issue 19 https://doi.org/10.1021/ic801007k	journal	October 2008
Magnetically Driven Ferroelectric Order in ${Ni}_{3} V_{2} O_{8}$ Lawes, G.; Harris, A. B.; Kimura, T. Physical Review Letters, Vol. 95, Issue 8 https://doi.org/10.1103/PhysRevLett.95.087205	journal	August 2005
Hydrothermal Synthesis of Vanadium Oxides Chirayil, Thomas; Zavalij, Peter Y.; Whittingham, M. Stanley Chemistry of Materials, Vol. 10, Issue 10 https://doi.org/10.1021/cm980242m	journal	October 1998
A Crystal-Chemical Approach to the Composition and Occurrence of Vanadium Minerals Schindler, M.; Hawthorne, F. C.; Baur, W. H. The Canadian Mineralogist, Vol. 38, Issue 6 https://doi.org/10.2113/gscanmin.38.6.1443	journal	December 2000
Ore-Forming Fluids Kesler, S. E. Elements, Vol. 1, Issue 1 https://doi.org/10.2113/gselements.1.1.13	journal	January 2005
Linear chain antiferromagnetism in Mn(HCOO)2 · 2H2O Wagner, G. R.; Friedberg, S. A. Physics Letters, Vol. 9, Issue 1 https://doi.org/10.1016/0031-9163(64)90194-5	journal	March 1964
Crystal structure refinement with SHELXL Sheldrick, George M. Acta Crystallographica Section C Structural Chemistry, Vol. 71, Issue 1, p. 3-8 https://doi.org/10.1107/S2053229614024218	journal	January 2015
The Versatile Chemistry and Noncentrosymmetric Crystal Structures of Salt-Inclusion Vanadate Hybrids Queen, Wendy L.; West, J. Palmer; Hwu, Shiou-Jyh Angewandte Chemie International Edition, Vol. 47, Issue 20 https://doi.org/10.1002/anie.200705113	journal	May 2008
Structural chemistry of vanadium oxides with open frameworks Zavalij, Peter Y.; Whittingham, M. Stanley Acta Crystallographica Section B Structural Science, Vol. 55, Issue 5 https://doi.org/10.1107/S0108768199004000	journal	October 1999
Synthesis and structural characterisation of transition metal fluoride sulfates Marshall, Kayleigh L.; Wang, Qianlong; Sullivan, Hannah S. I. Dalton Transactions, Vol. 45, Issue 21 https://doi.org/10.1039/C6DT00582A	journal	January 2016
Hydrothermal synthesis of single crystals of transition metal vanadates in the glaserite phase Sanjeewa, Liurukara D.; McMillen, Colin D.; Willett, Daniel Journal of Solid State Chemistry, Vol. 236 https://doi.org/10.1016/j.jssc.2015.07.039	journal	April 2016
Growth of oxygen deficiency-free YVO4 single crystal by top-seeded solution growth technique Erdei, S. Journal of Crystal Growth, Vol. 134, Issue 1-2 https://doi.org/10.1016/0022-0248(93)90002-E	journal	November 1993
The crystal chemistry of the M+VO3 (M+ = Li, Na, K, NH4, Tl, Rb, and Cs) pyroxenes Hawthorne, F. C.; Calvo, C. Journal of Solid State Chemistry, Vol. 22, Issue 2 https://doi.org/10.1016/0022-4596(77)90033-0	journal	October 1977
On the Origin of the Differences in Structure Directing Properties of Polar Metal Oxyfluoride [MO _x F _{6– x} ] ^2– ( x = 1, 2) Building Units Gautier, Romain; Gautier, Régis; Chang, Kelvin B. Inorganic Chemistry, Vol. 54, Issue 4 https://doi.org/10.1021/ic5026735	journal	January 2015
Synthesis and characterization of new fluoride-containing manganese vanadates A2Mn2V2O7F2 (A=Rb, Cs) and Mn2VO4F Sanjeewa, Liurukara D.; McGuire, Michael A.; Smith Pellizzeri, Tiffany M. Journal of Solid State Chemistry, Vol. 241 https://doi.org/10.1016/j.jssc.2016.05.008	journal	September 2016
Crystal growth, structure, and properties of manganese orthovanadate Mn3(VO4)2 Wang, Xiandong; Liu, Zhenquan; Ambrosini, Andrea Solid State Sciences, Vol. 2, Issue 1 https://doi.org/10.1016/S1293-2558(00)00104-7	journal	January 2000
Chlorovanadates with Original Chain and Layered Structures: AVO3Cl (A=Ba, Sr, Cd) Borel, M. M.; Chardon, J.; Leclaire, A. Journal of Solid State Chemistry, Vol. 145, Issue 2 https://doi.org/10.1006/jssc.1999.8266	journal	July 1999
Hydrothermal synthesis as a route to mineralogically-inspired structures McMillen, Colin D.; Kolis, Joseph W. Dalton Transactions, Vol. 45, Issue 7 https://doi.org/10.1039/C5DT03424H	journal	January 2016
Linear-Chain Antiferromagnetism in [ ${(C H_{3})}_{4}$ N] [Mn ${Cl}_{3}$ ] Dingle, R.; Lines, M. E.; Holt, S. L. Physical Review, Vol. 187, Issue 2 https://doi.org/10.1103/PhysRev.187.643	journal	November 1969
Polar Alignment of Λ-Shaped Basic Building Units within Transition Metal Oxide Fluoride Materials Holland, Michael; Donakowski, Martin D.; Pozzi, Eric A. Inorganic Chemistry, Vol. 53, Issue 1 https://doi.org/10.1021/ic402177j	journal	December 2013
Iron fluorophosphates Keates, Adam C.; Armstrong, Jennifer A.; Weller, Mark T. Dalton Transactions, Vol. 42, Issue 30 https://doi.org/10.1039/c3dt50324k	journal	January 2013
Magnetic Properties of ${Mn}_{3}$ $O_{4}$ and the Canted Spin Problem Dwight, Kirby; Menyuk, Norman Physical Review, Vol. 119, Issue 5 https://doi.org/10.1103/PhysRev.119.1470	journal	September 1960
$A$ Ag $_{2} M$ [VO $_{4}]_{2}$ ( $A = Ba, Sr$ ; $M = Co, Ni$ ): A series of ferromagnetic insulators Möller, Angela; Amuneke, Ngozi E.; Daniel, Phillip Physical Review B, Vol. 85, Issue 21 https://doi.org/10.1103/PhysRevB.85.214422	journal	June 2012
Honeycomb-like S = 5/2 Spin–Lattices in Manganese(II) Vanadates Sanjeewa, Liurukara. D.; McGuire, Michael A.; McMillen, Colin D. Inorganic Chemistry, Vol. 55, Issue 18 https://doi.org/10.1021/acs.inorgchem.6b01286	journal	August 2016
Structural and magnetic characterization of the one-dimensional $S = 5 / 2$ antiferromagnetic chain system $SrMn (V O_{4}) (OH)$ Sanjeewa, Liurukara D.; Garlea, Vasile O.; McGuire, Michael A. Physical Review B, Vol. 93, Issue 22 https://doi.org/10.1103/PhysRevB.93.224407	journal	June 2016
Manganese Vanadate Chemistry in Hydrothermal BaF ₂ Brines: Ba ₃ Mn ₂ (V ₂ O ₇ ) ₂ F ₂ and Ba ₇ Mn ₈ O ₂ (VO ₄ ) ₂ F ₂₃ Sanjeewa, Liurukara D.; McMillen, Colin D.; McGuire, Michael A. Inorganic Chemistry, Vol. 55, Issue 24 https://doi.org/10.1021/acs.inorgchem.6b02355	journal	December 2016
A review of crystal chemistry of natural silicates of alkaline elements in the light of new structural data Zubkova, N. V.; Pekov, I. V.; Pushcharovsky, D. Yu. Mineralogical Magazine, Vol. 78, Issue 2 https://doi.org/10.1180/minmag.2014.078.2.03	journal	April 2014
Noncentrosymmetric salt inclusion oxides: Role of salt lattices and counter ions in bulk polarity West, J. Palmer; Hwu, Shiou-Jyh Journal of Solid State Chemistry, Vol. 195 https://doi.org/10.1016/j.jssc.2012.06.015	journal	November 2012
Rapid reactions between CO2, brine and silicate minerals during geological carbon storage: Modelling based on a field CO2 injection experiment Bickle, Mike; Kampman, Niko; Chapman, Hazel Chemical Geology, Vol. 468 https://doi.org/10.1016/j.chemgeo.2017.07.031	journal	September 2017
M ₃ (P ₂ O ₇ ) ₂ ^2– -Type Open Frameworks Featuring [M ₂ O ₈ ] and [M ₃ O ₁₂ ] Multinuclear Transition-Metal Oxide Units. Serendipitous Synthesis of Six Polymorphic Salt-Inclusion Magnetic Solids: Na ₂ M ₃ (P ₂ O ₇ ) ₂ ·ACl (M = Mn, Fe; A = Rb, Cs) and K ₂ M ₃ (P ₂ O ₇ ) ₂ ·CsCl (M = Fe, Mn) Gao, Jianhua; Li, Jian; Sulejmanovic, Dino Inorganic Chemistry, Vol. 54, Issue 3 https://doi.org/10.1021/ic5024696	journal	November 2014
The Versatile Chemistry and Noncentrosymmetric Crystal Structures of Salt-Inclusion Vanadate Hybrids Queen, Wendy L.; West, J. Palmer; Hwu, Shiou-Jyh Angewandte Chemie, Vol. 120, Issue 20 https://doi.org/10.1002/ange.200705113	journal	May 2008
Structural chemistry of silicates Smith, Dean Materials Research Bulletin, Vol. 21, Issue 12 https://doi.org/10.1016/0025-5408(86)90097-8	journal	December 1986
Rapid reactions between CO2, brine and silicate minerals during geological carbon storage: Modelling based on a field CO2 injection experiment Bickle, Michael; Kampman, N.; Chapman, H. Apollo - University of Cambridge Repository https://doi.org/10.17863/cam.12494	text	January 2017
Hydrothermal Synthesis of Vanadium Oxides Chirayil, Thomas; Zavalij, Peter; Stanley Whittingham, M. MRS Proceedings, Vol. 453 https://doi.org/10.1557/proc-453-135	journal	January 1996

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Single crystal neutron and magnetic measurements of Rb ₂ Mn ₃ (VO ₄ ) ₂ CO ₃ and K ₂ Co ₃ (VO ₄ ) ₂ CO ₃ with mixed honeycomb and triangular magnetic lattices Smith Pellizzeri, Tiffany M.; Sanjeewa, Liurukara D.; Pellizzeri, Steven Dalton Transactions, Vol. 49, Issue 14 https://doi.org/10.1039/c9dt03389k	journal	January 2020

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