Detection and identification of solids, surfaces, and solutions of uranium using vibrational spectroscopy

Lu, Grace; Haes, Amanda J.; Forbes, Tori Z.

doi:10.1016/j.ccr.2018.07.010

Title: Detection and identification of solids, surfaces, and solutions of uranium using vibrational spectroscopy

Journal Article · 30 July 2018 · Coordination Chemistry Reviews

DOI: https://doi.org/10.1016/j.ccr.2018.07.010 · OSTI ID:1668719

Lu, Grace ^[1]; Haes, Amanda J. ^[2]; Forbes, Tori Z. ^[2]

Univ. of Iowa, Iowa City, IA (United States); University of Iowa
Univ. of Iowa, Iowa City, IA (United States)

The purpose of this review is to provide an overview of uranium speciation using vibrational spectroscopy methods including Raman and IR. Uranium is a naturally occurring, radioactive element that is utilized in the nuclear energy and national security sectors. Fundamental uranium chemistry is also an active area of investigation due to ongoing questions regarding the participation of 5f orbitals in bonding, variation in oxidation states and coordination environments, and unique chemical and physical properties. Importantly, uranium speciation affects fate and transportation in the environment, influences bioavailability and toxicity to human health, controls separation processes for nuclear waste, and impacts isotopic partitioning and geochronological dating. This work provides a thorough discussion of the vibrational modes for U(IV), U(V), and U(VI) and applications of infrared absorption and Raman scattering spectroscopies in the identification and detection of both naturally occurring and synthetic uranium species in solid and solution states. The vibrational frequencies of the uranyl moiety, including both symmetric and asymmetric stretches are sensitive to the coordinating ligands and used to identify individual species in water, organic solvents, and ionic liquids or on the surface of materials. Additionally, vibrational spectroscopy allows for the in situ detection and real-time monitoring of chemical reactions involving uranium. Finally, techniques to enhance uranium species signals with vibrational modes are discussed to expand the application of vibrational spectroscopy to biological, environmental, inorganic, and materials scientists and engineers.

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Research Organization:: Univ. of Iowa, Iowa City, IA (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES). Chemical Sciences, Geosciences & Biosciences Division

Grant/Contract Number:: SC0013980

OSTI ID:: 1668719

Alternate ID(s):: OSTI ID: 1612053

Journal Information:: Coordination Chemistry Reviews, Journal Name: Coordination Chemistry Reviews Vol. 374; ISSN 0010-8545

Publisher:: ElsevierCopyright Statement

Country of Publication:: United States

Language:: English

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First Actinide Complexes of the Nitrogen-Containing Ligands Dinitramide (N(NO ₂ ) ₂ ⁻ ), 4,5-Dicyano-1,2,3-triazolate (C ₄ N ₅ ⁻ ), and Dicyanamide (N(CN) ₂ ⁻ ) Crawford, Margaret-Jane; Ellern, Arkady; Karaghiosoff, Konstantin Inorganic Chemistry, Vol. 49, Issue 6 https://doi.org/10.1021/ic901820b	journal	March 2010
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Spectral Analysis of the Uranyl Squarate and Croconate System: Evaluating Differences between the Solution and Solid-State Phases Basile, M.; Unruh, D. K.; Streicher, L. Crystal Growth & Design, Vol. 17, Issue 10 https://doi.org/10.1021/acs.cgd.7b00838	journal	September 2017
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Two Systems of [DabcoH ₂ ] ²⁺ /[PipH ₂ ] ²⁺ –Uranyl–Oxalate Showing Reversible Crystal-to-Crystal Transformations Controlled by the Diammonium/Uranyl/Oxalate Ratios in Aqueous Solutions ([DabcoH ₂ ] ²⁺ = 1,4-Diazabicyclo-[2.2.2]-octaneH ₂ and [PipH ₂ ] ²⁺ = PiperazineH ₂ ) Wang, Lu-Hua; Shang, Ran; Zheng, Zhong Crystal Growth & Design, Vol. 13, Issue 6 https://doi.org/10.1021/cg400364x	journal	April 2013
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Micro-Raman Spectrum of Triuranium Octoxide, U ₃ O ₈ Butler, Ian S.; Allen, Geoffrey C.; Tuan, Nguyen A. Applied Spectroscopy, Vol. 42, Issue 5 https://doi.org/10.1366/0003702884428888	journal	July 1988
Influence of extreme conditions on the formation and structures of caesium uranium( vi ) arsenates Yu, Na; Kegler, Philip; Klepov, Vladislav V. Dalton Transactions, Vol. 44, Issue 47 https://doi.org/10.1039/C5DT03842A	journal	January 2015
Crystal structure and formula revision of deliensite, Fe[(UO ₂ ) ₂ (SO ₄ ) ₂ (OH) ₂ ](H ₂ O) ₇ Plášil, J.; Hauser, J.; Petříček, V. Mineralogical Magazine, Vol. 76, Issue 7 https://doi.org/10.1180/minmag.2012.076.7.14	journal	December 2012
Raman spectroscopic study of the uranyl selenite mineral demesmaekerite Pb ₂ Cu ₅ (UO ₂ ) ₂ (SeO ₃ ) ₆ (OH) ₆ ·2H ₂ O Frost, Ray L.; Čejka, Jiří; Dickfos, Marilla J. Journal of Raman Spectroscopy, Vol. 40, Issue 5 https://doi.org/10.1002/jrs.2074	journal	May 2009
Crystal structure of the uranyl-oxide mineral rameauite [Crystal structure of the uranyl-oxide mineral rameauite] Plášil, Jakub; Škoda, Radek; Čejka, Jiří European Journal of Mineralogy, Vol. 28, Issue 5 https://doi.org/10.1127/ejm/2016/0028-2568	journal	January 2016
Sulfate-Centered Sodium-Icosahedron-Templated Uranyl Peroxide Phosphate Cages with Uranyl Bridged by μ–η ¹ :η ² Peroxide Qiu, Jie; Spano, Tyler L.; Dembowski, Mateusz Inorganic Chemistry, Vol. 56, Issue 4 https://doi.org/10.1021/acs.inorgchem.6b02429	journal	January 2017
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K ₃ (U ₃ O ₆ )(Si ₂ O ₇ ) and Rb ₃ (U ₃ O ₆ )(Ge ₂ O ₇ ): A Pentavalent-Uranium Silicate and Germanate Lin, Chia-Hui; Chen, Chih-Shan; Shiryaev, A. A. Inorganic Chemistry, Vol. 47, Issue 11 https://doi.org/10.1021/ic800300v	journal	June 2008
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Evaluation of the Behavior of Uranium Peroxocarbonate Complexes in Na–U(VI)–CO ₃ –OH–H ₂ O ₂ Solutions by Raman Spectroscopy Kim, Kwang-Wook; Jung, Euo-Chang; Lee, Keun-Young The Journal of Physical Chemistry A, Vol. 116, Issue 49 https://doi.org/10.1021/jp307062u	journal	November 2012
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Self-Assembly of Uranyl-Peroxide Nanocapsules in Basic Peroxidic Environments Miró, Pere; Vlaisavljevich, Bess; Gil, Adria Chemistry - A European Journal, Vol. 22, Issue 25 https://doi.org/10.1002/chem.201600390	journal	May 2016
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Molecular structure of the uranyl silicates—a Raman spectroscopic study Frost, Ray L.; Čejka, Jiří; Weier, Matt L. Journal of Raman Spectroscopy, Vol. 37, Issue 4 https://doi.org/10.1002/jrs.1430	journal	January 2006
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A Raman spectroscopic study of the uranyl carbonate rutherfordine Frost, Ray L.; Čejka, Jiří Journal of Raman Spectroscopy, Vol. 38, Issue 11 https://doi.org/10.1002/jrs.1796	journal	January 2007
Structural characterization of environmentally relevant ternary uranyl citrate complexes present in aqueous solutions and solid state materials Basile, Madeline; Unruh, Daniel K.; Flores, Erin Dalton Transactions, Vol. 44, Issue 6 https://doi.org/10.1039/C4DT02442G	journal	January 2015
METARAUCHITE, Ni(UO2)2(AsO4)2{middle dot}8H2O, FROM JACHYMOV, CZECH REPUBLIC, AND SCHNEEBERG, GERMANY: A NEW MEMBER OF THE AUTUNITE GROUP Plail, J.; Sejkora, J.; ejka, J. The Canadian Mineralogist, Vol. 48, Issue 2 https://doi.org/10.3749/canmin.48.2.335	journal	April 2010
XAFS investigation of polyamidoxime-bound uranyl contests the paradigm from small molecule studies Abney, C. W.; Mayes, R. T.; Piechowicz, M. Energy & Environmental Science, Vol. 9, Issue 2 https://doi.org/10.1039/C5EE02913A	journal	January 2016
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The structural and spectroscopic characterisation of three actinyl complexes with coordinated and uncoordinated perrhenate: [UO ₂ (ReO ₄ ) ₂ (TPPO) ₃ ], [{(UO ₂ )(TPPO) ₃ } ₂ (µ ₂ -O ₂ )][ReO ₄ ] ₂ and [NpO ₂ (TPPO) ₄ ][ReO ₄ ] John, Gordon H.; May, Iain; Sarsfield, Mark J. Dalton Trans., Issue 5 https://doi.org/10.1039/B313045B	journal	January 2004
Structural and spectroscopic characterization of two new layered uranyl(VI) p-xylenediphosphonate compounds synthesized via ionothermal method Zheng, Tao; Gao, Yang; Chen, Lanhua Inorganica Chimica Acta, Vol. 435 https://doi.org/10.1016/j.ica.2015.06.011	journal	August 2015
Occurence of an Octanuclear Motif of Uranyl Isophthalate with Cation–Cation Interactions through Edge-Sharing Connection Mode Mihalcea, Ionut; Henry, Natacha; Clavier, Nicolas Inorganic Chemistry, Vol. 50, Issue 13 https://doi.org/10.1021/ic2005584	journal	July 2011
Optical properties of tetravalent uranium complexes in non-aqueous media Aoyagi, Noboru; Watanabe, Masayuki; Kirishima, Akira Journal of Radioanalytical and Nuclear Chemistry, Vol. 303, Issue 2 https://doi.org/10.1007/s10967-014-3616-x	journal	September 2014
Raman Spectroscopic and ESI-MS Characterization of Uranyl Peroxide Cage Clusters McGrail, Brendan T.; Sigmon, Ginger E.; Jouffret, Laurent J. Inorganic Chemistry, Vol. 53, Issue 3 https://doi.org/10.1021/ic402570b	journal	January 2014
Raman spectroscopic study of the uranyl mineral, compreignacite, K ₂ [(UO ₂ ) ₃ O ₂ (OH) ₃ ] ₂ ·7H ₂ O Frost, Ray L.; Dickfos, Marilla J.; Čejka, Jiří Journal of Raman Spectroscopy, Vol. 39, Issue 9 https://doi.org/10.1002/jrs.1955	journal	September 2008
Fourier transform infrared and Raman spectra of uranyl bis(2-hydroxybenzaldehyde): UO2(sal)2 Téllez-Sara, C. A.; Arissawa, M.; Gómez-Lara, J. Polyhedron, Vol. 19, Issue 22-23 https://doi.org/10.1016/S0277-5387(00)00571-4	journal	November 2000
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Sorption of radionuclides from aqueous systems onto graphene oxide-based materials: a review Yu, Shujun; Wang, Xiangxue; Tan, Xiaoli Inorganic Chemistry Frontiers, Vol. 2, Issue 7 https://doi.org/10.1039/C4QI00221K	journal	January 2015
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Formation of a uranyl hydroxide hydrate via hydration of [(UO ₂ F ₂ )(H ₂ O)] ₇ ·4H ₂ O Kirkegaard, Marie C.; Spano, Tyler L.; Ambrogio, Michael W. Dalton Transactions, Vol. 48, Issue 36 https://doi.org/10.1039/c9dt02835h	journal	January 2019
Two New Coordination Polymers with UO ₂ ²⁺ Units and Fluorinated Aromatic Carboxylate Linkers Christoffels, Ronja; Ruschewitz, Uwe Zeitschrift für anorganische und allgemeine Chemie, Vol. 646, Issue 3 https://doi.org/10.1002/zaac.201900302	journal	January 2020
Combined experimental and first-principles studies of a hydrated uranyl carbonate: Insight into phonon spectra for a core environmental class of uranium materials Kalashnyk, N.; Perry, D. L.; Ivanov, V. G. Journal of Physics and Chemistry of Solids, Vol. 138 https://doi.org/10.1016/j.jpcs.2019.109260	journal	March 2020
Mineralogy, Crystallography and Structural Complexity of Natural Uranyl Silicates Plášil, Jakub Minerals, Vol. 8, Issue 12 https://doi.org/10.3390/min8120551	journal	November 2018
Impacts of hydrogen bonding interactions with Np( v / vi )O ₂ Cl ₄ complexes: vibrational spectroscopy, redox behavior, and computational analysis Pyrch, Mikaela M.; Bjorklund, Jennifer L.; Williams, James M. Dalton Transactions, Vol. 49, Issue 20 https://doi.org/10.1039/d0dt00848f	journal	January 2020

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