skip to main content
DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Insight into selectivity: uptake studies of radionuclides 90 Sr 2+ , 137 Cs + , and 233 UO 2 2+ with bis-amidoxime polymers

Abstract

Density functional theory and separation experiments combine to demonstrate the selectivity of bis-amidoxime polymer for uranyl extraction from aqueous solution.

Authors:
ORCiD logo [1];  [2]; ORCiD logo [2]
  1. Chemical Sciences and Engineering Division, Argonne National Laboratory, Argonne, USA, Department of Chemistry
  2. Chemical Sciences and Engineering Division, Argonne National Laboratory, Argonne, USA
Publication Date:
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1434157
Grant/Contract Number:  
AC02-06CH11357
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
Dalton Transactions
Additional Journal Information:
Journal Name: Dalton Transactions Journal Volume: 47 Journal Issue: 15; Journal ID: ISSN 1477-9226
Publisher:
Royal Society of Chemistry (RSC)
Country of Publication:
United Kingdom
Language:
English

Citation Formats

Piechowicz, Marek, Chiarizia, R., and Soderholm, L. Insight into selectivity: uptake studies of radionuclides 90 Sr 2+ , 137 Cs + , and 233 UO 2 2+ with bis-amidoxime polymers. United Kingdom: N. p., 2018. Web. doi:10.1039/C7DT04935H.
Piechowicz, Marek, Chiarizia, R., & Soderholm, L. Insight into selectivity: uptake studies of radionuclides 90 Sr 2+ , 137 Cs + , and 233 UO 2 2+ with bis-amidoxime polymers. United Kingdom. doi:10.1039/C7DT04935H.
Piechowicz, Marek, Chiarizia, R., and Soderholm, L. Mon . "Insight into selectivity: uptake studies of radionuclides 90 Sr 2+ , 137 Cs + , and 233 UO 2 2+ with bis-amidoxime polymers". United Kingdom. doi:10.1039/C7DT04935H.
@article{osti_1434157,
title = {Insight into selectivity: uptake studies of radionuclides 90 Sr 2+ , 137 Cs + , and 233 UO 2 2+ with bis-amidoxime polymers},
author = {Piechowicz, Marek and Chiarizia, R. and Soderholm, L.},
abstractNote = {Density functional theory and separation experiments combine to demonstrate the selectivity of bis-amidoxime polymer for uranyl extraction from aqueous solution.},
doi = {10.1039/C7DT04935H},
journal = {Dalton Transactions},
number = 15,
volume = 47,
place = {United Kingdom},
year = {2018},
month = {1}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record
DOI: 10.1039/C7DT04935H

Save / Share:

Works referenced in this record:

Tuning Amidoximate to Enhance Uranyl Binding: A Density Functional Theory Study
journal, October 2013

  • Abney, Carter W.; Liu, Shubin; Lin, Wenbin
  • The Journal of Physical Chemistry A, Vol. 117, Issue 45
  • DOI: 10.1021/jp408460x

Predicting Stability Constants for Uranyl Complexes Using Density Functional Theory
journal, March 2015


A theoretical study of uranyl hydroxide monomeric and dimeric complexes
journal, October 2001


Functionalized Porous Aromatic Framework for Efficient Uranium Adsorption from Aqueous Solutions
journal, March 2017

  • Li, Baiyan; Sun, Qi; Zhang, Yiming
  • ACS Applied Materials & Interfaces, Vol. 9, Issue 14
  • DOI: 10.1021/acsami.7b01711

Metal Salts of 4,5-Dinitro-1,3-imidazole as Colorants in Pyrotechnic Compositions: Metal Salts of 4,5-Dinitro-1,3-imidazole as Colorants in Pyrotechnic Compositions
journal, March 2014

  • Klapötke, Thomas M.; Müller, Thomas G.; Rusan, Magdalena
  • Zeitschrift für anorganische und allgemeine Chemie, Vol. 640, Issue 7
  • DOI: 10.1002/zaac.201400082

Binding Properties of a Polymer Having Amidoxime Groups with Proton and Metal Ions
journal, December 1986

  • Hirotsu, Takahiro; Katoh, Shunsaku; Sugasaka, Kazuhiko
  • Separation Science and Technology, Vol. 21, Issue 10
  • DOI: 10.1080/01496398608058400

A Novel Strontium-Selective Extraction Chromatographic Resin*
journal, April 1992

  • Philip Horwitz, E.; Chiarizia, Renato; Dietz, Mark L.
  • Solvent Extraction and Ion Exchange, Vol. 10, Issue 2
  • DOI: 10.1080/07366299208918107

An Amidoximated-UHMEPE Fiber for Selective and High Efficient Removal of Uranyl and Thorium from Acid Aqueous Solution
journal, January 2017

  • Jin, Chan; Hu, Jiangtao; Wang, Jianqiang
  • Advances in Chemical Engineering and Science, Vol. 07, Issue 01
  • DOI: 10.4236/aces.2017.71005

Recognition and Extraction of Cesium Hydroxide and Carbonate by Using a Neutral Multitopic Ion-Pair Receptor
journal, August 2017

  • He, Qing; Peters, Gretchen Marie; Lynch, Vincent M.
  • Angewandte Chemie International Edition, Vol. 56, Issue 43
  • DOI: 10.1002/anie.201705788

A Planar[15]Metallacrown-5 That Selectively Binds the Uranyl Cation
journal, December 1996

  • Stemmler, Ann J.; Kampf, Jeff W.; Pecoraro, Vincent L.
  • Angewandte Chemie International Edition in English, Vol. 35, Issue 2324
  • DOI: 10.1002/anie.199628411

A Selectivity Scale for Some Monovalent Cations on Dowex 50
journal, April 1954


Structural clues to UO 2 2+ /VO 2 + competition in seawater extraction using amidoxime-based extractants
journal, January 2014

  • Kelley, Steven P.; Barber, Patrick S.; Mullins, Peter H. K.
  • Chem. Commun., Vol. 50, Issue 83
  • DOI: 10.1039/C4CC06370H

Acidity of the Amidoxime Functional Group in Aqueous Solution: A Combined Experimental and Computational Study
journal, February 2015

  • Mehio, Nada; Lashely, Mark A.; Nugent, Joseph W.
  • The Journal of Physical Chemistry B, Vol. 119, Issue 8
  • DOI: 10.1021/jp512778x

Highly porous and stable metal–organic frameworks for uranium extraction
journal, January 2013

  • Carboni, Michaël; Abney, Carter W.; Liu, Shubin
  • Chemical Science, Vol. 4, Issue 6, p. 2396-2402
  • DOI: 10.1039/c3sc50230a

DFT modeling on the suitable crown ether architecture for complexation with Cs+ and Sr2+ metal ions
journal, July 2010

  • Boda, Anil; Ali, Sk. Musharaf; Shenoi, Madhav R. K.
  • Journal of Molecular Modeling, Vol. 17, Issue 5
  • DOI: 10.1007/s00894-010-0812-7

Scientific Basis for Efficient Extraction of Uranium from Seawater. I: Understanding the Chemical Speciation of Uranium under Seawater Conditions
journal, December 2015

  • Endrizzi, Francesco; Leggett, Christina J.; Rao, Linfeng
  • Industrial & Engineering Chemistry Research, Vol. 55, Issue 15
  • DOI: 10.1021/acs.iecr.5b03679

De Novo Structure-Based Design of Bis-amidoxime Uranophiles
journal, June 2013

  • Vukovic, Sinisa; Hay, Benjamin P.
  • Inorganic Chemistry, Vol. 52, Issue 13
  • DOI: 10.1021/ic401089u

Successful Coupling of a Bis-Amidoxime Uranophile with a Hydrophilic Backbone for Selective Uranium Sequestration
journal, August 2017

  • Piechowicz, Marek; Abney, Carter W.; Thacker, Nathan C.
  • ACS Applied Materials & Interfaces, Vol. 9, Issue 33
  • DOI: 10.1021/acsami.7b04656

Materials for the Recovery of Uranium from Seawater
journal, June 2017


Examining the Performance of DFT Methods in Uranium Chemistry: Does Core Size Matter for a Pseudopotential?
journal, August 2008

  • Iché-Tarrat, Nathalie; Marsden, Colin J.
  • The Journal of Physical Chemistry A, Vol. 112, Issue 33
  • DOI: 10.1021/jp801124u

Development of Sorbers for the Recovery of Uranium from Seawater. 1. Assessment of Key Parameters and Screening Studies of Sorber Materials
journal, August 1982

  • Schenk, H. J.; Astheimer, L.; Witte, E. G.
  • Separation Science and Technology, Vol. 17, Issue 11
  • DOI: 10.1080/01496398208056103

Quantum Chemistry Study of Uranium(VI), Neptunium(V), and Plutonium(IV,VI) Complexes with Preorganized Tetradentate Phenanthrolineamide Ligands
journal, September 2014

  • Xiao, Cheng-Liang; Wu, Qun-Yan; Wang, Cong-Zhi
  • Inorganic Chemistry, Vol. 53, Issue 20
  • DOI: 10.1021/ic500816z

Polypropylene Modified with Amidoxime/Carboxyl Groups in Separating Uranium(VI) from Thorium(IV) in Aqueous Solutions
journal, December 2016


Complexation of glutarimidedioxime with Fe(iii), Cu(ii), Pb(ii), and Ni(ii), the competing ions for the sequestration of U(vi) from seawater
journal, January 2013

  • Sun, Xiaoqi; Xu, Chao; Tian, Guoxin
  • Dalton Transactions, Vol. 42, Issue 40
  • DOI: 10.1039/c3dt51767e

Amidoximes as ligand functionalities for braided polymeric materials for the recovery of uranium from seawater
journal, April 2016


Chelating polymers and related supports for separation and preconcentration of trace metals
journal, May 1990


How Amidoximate Binds the Uranyl Cation
journal, February 2012

  • Vukovic, Sinisa; Watson, Lori A.; Kang, Sung Ok
  • Inorganic Chemistry, Vol. 51, Issue 6
  • DOI: 10.1021/ic300062s

Advances in Sample Extraction
journal, December 2015


Extraction of Lanthanide and Actinide Ions from Aqueous Mixtures Using a Carboxylic Acid-Functionalized Porous Aromatic Framework
journal, April 2016


Persistently Folded Circular Aromatic Amide Pentamers Containing Modularly Tunable Cation-Binding Cavities with High Ion Selectivity
journal, July 2010

  • Qin, Bo; Ren, Changliang; Ye, Ruijuan
  • Journal of the American Chemical Society, Vol. 132, Issue 28
  • DOI: 10.1021/ja1035804

Novel Metal–Organic Framework (MOF) Based Composite Material for the Sequestration of U(VI) and Th(IV) Metal Ions from Aqueous Environment
journal, October 2017

  • Alqadami, Ayoub Abdullah; Naushad, Mu.; Alothman, Zeid Abdullah
  • ACS Applied Materials & Interfaces, Vol. 9, Issue 41
  • DOI: 10.1021/acsami.7b10768

Density‐functional thermochemistry. III. The role of exact exchange
journal, April 1993

  • Becke, Axel D.
  • The Journal of Chemical Physics, Vol. 98, Issue 7, p. 5648-5652
  • DOI: 10.1063/1.464913

K 2x Sn 4−x S 8−x (x = 0.65–1): a new metal sulfide for rapid and selective removal of Cs + , Sr 2+ and UO 2 2+ ions
journal, January 2016

  • Sarma, Debajit; Malliakas, Christos D.; Subrahmanyam, K. S.
  • Chemical Science, Vol. 7, Issue 2
  • DOI: 10.1039/C5SC03040D

Multiwfn: A multifunctional wavefunction analyzer
journal, December 2011

  • Lu, Tian; Chen, Feiwu
  • Journal of Computational Chemistry, Vol. 33, Issue 5
  • DOI: 10.1002/jcc.22885

A comprehensive study of the complexation of alkali metal cations by lower rim calix[4]arene amide derivatives
journal, January 2017

  • Horvat, Gordan; Frkanec, Leo; Cindro, Nikola
  • Physical Chemistry Chemical Physics, Vol. 19, Issue 35
  • DOI: 10.1039/C7CP03920D

Diphonix® Resin: A Review of Its Properties and Applications
journal, January 1997

  • Chiariza, R.; Horwitz, E. P.; Alexandrators, S. D.
  • Separation Science and Technology, Vol. 32, Issue 1-4
  • DOI: 10.1080/01496399708003184

Highly Porous Acrylonitrile-Based Submicron Particles for UO 2 2+ Absorption in an Immunosensor Assay
journal, December 2011

  • Sahiner, Nurettin; Yu, Haini; Tan, Grace
  • ACS Applied Materials & Interfaces, Vol. 4, Issue 1
  • DOI: 10.1021/am201204r

Probing the Nature of Chemical Bonding in Uranyl(VI) Complexes with Quantum Chemical Methods
journal, November 2012

  • Vallet, Valérie; Wahlgren, Ulf; Grenthe, Ingmar
  • The Journal of Physical Chemistry A, Vol. 116, Issue 50
  • DOI: 10.1021/jp3091123

Overcoming the crystallization and designability issues in the ultrastable zirconium phosphonate framework system
journal, May 2017

  • Zheng, Tao; Yang, Zaixing; Gui, Daxiang
  • Nature Communications, Vol. 8, Issue 1
  • DOI: 10.1038/ncomms15369

Interaction of Cesium Ions with Calix[4]arene-bis( t -octylbenzo-18-crown-6): NMR and Theoretical Study
journal, June 2011

  • Kříž, Jaroslav; Dybal, Jiří; Makrlík, Emanuel
  • The Journal of Physical Chemistry B, Vol. 115, Issue 23
  • DOI: 10.1021/jp203221k

Recovery of Uranium from Seawater: A Review of Current Status and Future Research Needs
journal, January 2013


Extracting Uranium from Seawater: Promising AI Series Adsorbents
journal, November 2015

  • Das, S.; Oyola, Y.; Mayes, R. T.
  • Industrial & Engineering Chemistry Research, Vol. 55, Issue 15
  • DOI: 10.1021/acs.iecr.5b03135

Acidity of the Poly(acrylamidoxime) Adsorbent in Aqueous Solution: Determination of the Proton Affinity Distribution via Potentiometric Titrations
journal, December 2015

  • Mehio, Nada; Williamson, Ben; Oyola, Yatsandra
  • Industrial & Engineering Chemistry Research, Vol. 55, Issue 15
  • DOI: 10.1021/acs.iecr.5b03211

Mandelohydroxamic Acid as Ligand for Copper(II) 15-Metallacrown-5 Lanthanide(III) and Copper(II) 15-Metallacrown-5 Uranyl Complexes
journal, April 2006

  • Parac-Vogt, Tatjana N.; Pacco, Antoine; Nockemann, Peter
  • European Journal of Inorganic Chemistry, Vol. 2006, Issue 7
  • DOI: 10.1002/ejic.200501015

XAFS investigation of polyamidoxime-bound uranyl contests the paradigm from small molecule studies
journal, January 2016

  • Abney, C. W.; Mayes, R. T.; Piechowicz, M.
  • Energy & Environmental Science, Vol. 9, Issue 2
  • DOI: 10.1039/C5EE02913A

Theoretical Investigations of Uranyl−Ligand Bonding:  Four- and Five-Coordinate Uranyl Cyanide, Isocyanide, Carbonyl, and Hydroxide Complexes
journal, April 2005

  • Sonnenberg, Jason L.; Hay, P. Jeffrey; Martin, Richard L.
  • Inorganic Chemistry, Vol. 44, Issue 7
  • DOI: 10.1021/ic048567u

Thorium(IV) and neptunium(V) uptake from carbonate containing aqueous solutions by HDTMA-modified natural zeolites
journal, November 2016

  • Misaelides, Panagiotis; Fellhauer, David; Gaona, Xavier
  • Journal of Radioanalytical and Nuclear Chemistry, Vol. 311, Issue 3
  • DOI: 10.1007/s10967-016-5121-x

From microhydration to bulk hydration of Sr2+ metal ion: DFT, MP2 and molecular dynamics study
journal, August 2012


Energies, structures, and electronic properties of molecules in solution with the C-PCM solvation model
journal, April 2003

  • Cossi, Maurizio; Rega, Nadia; Scalmani, Giovanni
  • Journal of Computational Chemistry, Vol. 24, Issue 6
  • DOI: 10.1002/jcc.10189