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Russian Chemical Reviews, 2016, Volume 85, Issue 9, Pages 917–942
DOI: https://doi.org/10.1070/RCR4588
(Mi rcr4127)
 

This article is cited in 61 scientific papers (total in 61 papers)

Quantum chemical modelling of extraction separation of minor actinides and lanthanides: the state of the art

Yu. A. Ustynyuka, M. Yu. Alyapyshevbc, V. A. Babainc, N. A. Ustynyukd

a Lomonosov Moscow State University, Faculty of Chemistry
b RPA 'V.G. Khlopin Radium Institute', St. Petersburg
c St. Petersburg State University of Information Technologies, Mechanics and Optics
d A. N. Nesmeyanov Institute of Organoelement Compounds of the Russian Academy of Sciences, Moscow
Abstract: The review deals with the results of theoretical modelling of the structures and properties of actinide and lanthanide complexes with donor organic ligands used as selective extractants for separation of these elements in liquid high-level waste processing in the nuclear fuel cycle. The advantages and drawbacks of various types of ligands are discussed, including phosphinodithioic acids, tri- and polydentate ligands with $\mathrm O$-donor centres, ligands based on $\mathrm N$-heterocycles with softer $\mathrm N$-donor centres and amides of $\mathrm N$-heterocyclic carboxylic acids, which contain both types of donor atoms. A critical analysis of the potential of modern quantum chemistry methods in establishing structure–extraction behaviour relationships for various types of ligands is presented.
The bibliography includes 119 references.
Funding agency Grant number
State Atomic Energy Corporation ROSATOM 6790Д
5/5974Д
Фонд "Национальное интеллектуальное развитие"
Received: 15.07.2015
Bibliographic databases:
Document Type: Article
Language: English
Original paper language: Russian
Citation: Yu. A. Ustynyuk, M. Yu. Alyapyshev, V. A. Babain, N. A. Ustynyuk, “Quantum chemical modelling of extraction separation of minor actinides and lanthanides: the state of the art”, Russian Chem. Reviews, 85:9 (2016), 917–942
Citation in format AMSBIB
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\by Yu.~A.~Ustynyuk, M.~Yu.~Alyapyshev, V.~A.~Babain, N.~A.~Ustynyuk
\paper Quantum chemical modelling of extraction separation of minor actinides and lanthanides: the state of the art
\jour Russian Chem. Reviews
\yr 2016
\vol 85
\issue 9
\pages 917--942
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\crossref{https://doi.org/10.1070/RCR4588}
\adsnasa{https://adsabs.harvard.edu/cgi-bin/bib_query?2016RuCRv..85..917U}
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  • https://doi.org/10.1070/RCR4588
  • https://www.mathnet.ru/eng/rcr/v85/i9/p917
  • This publication is cited in the following 61 articles:
    1. Pin-Wen Huang, Cong-Zhi Wang, Zhe Su, De-Xiang Jiang, Jun-Li Wang, Qun-Yan Wu, Jian-Hui Lan, Wei-Qun Shi, Supramolecular Materials, 2025, 100092  crossref
    2. Cheriyan Ebenezer, R. Vijay Solomon, Comments on Inorganic Chemistry, 2024, 1  crossref
    3. Kevin Leung, Anastasia G. Ilgen, Phys. Chem. Chem. Phys., 2024  crossref
    4. A. N. Turanov, V. K. Karandashev, E. I. Goryunov, I. B. Goryunova, V. K. Brel, Russ. J. Inorg. Chem., 2024  crossref
    5. A. N. Turanov, V. K. Karandashev, V. E. Baulin, D. V. Baulin, Radiochemistry, 66:4 (2024), 438  crossref
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    7. A. N. Turanov, V. K. Karandashev, O. I. Artyushin, E. V. Sharova, Žurnal obŝej himii, 94:6 (2024), 766  crossref
    8. Yichen Huang, Changming Nie, Congzhi Wang, Shusen Chen, Yan Song, Hao Li, Weiqun Shi, Acta Chimica Sinica, 82:10 (2024), 1050  crossref
    9. Thomas J. Summers, Michael G. Taylor, Logan J. Augustine, Jan Janssen, Danny Perez, Enrique R. Batista, Ping Yang, JACS Au, 2024  crossref
    10. A. N. Turanov, V. K. Karandashev, A. V. Kharlamov, N. A. Bondarenko, Russ. J. Inorg. Chem., 2024  crossref
    11. A. N. Turanov, V. K. Karandashev, Radiochemistry, 66:5 (2024), 633  crossref
    12. S. V. Gutorova, M. V. Logunov, Yu. A. Voroshilov, V. A. Babain, A. Yu. Shadrin, S. V. Podoynitsyn, O. V. Kharitonov, L. A. Firsova, E. A. Kozlitin, Yu. A. Ustynyuk, P. S. Lemport, V. G. Nenajdenko, A. V. Voronina, V. A. Volkovich, I. B. Polovov, K. N. Dvoeglazov, Yu. S. Mochalov, V. L. Vidanov, V. A. Kascheev, Yu. P. Zaikov, V. A. Kovrov, A. S. Holkina, D. Yu. Suntsov, E. D. Filimonova, O. V. Shmidt, V. I. Volk, A. B. Melentev, K. K. Korchenkin, K. E. German, Yu. A. Pokhitonov, I. G. Tananaev, E. Yu. Pavlyukevich, O. A. Bagautdinova, V. N. Alekseenko, L. N. Podrezova, V. V. Milyutin, N. A. Nekrasova, V. O. Kaptakov, L. I. Tkachenko, S. N. Kalmykov, Russ J Gen Chem, 94:S2 (2024), S243  crossref
    13. A. N. Turanov, V. K. Karandashev, G. V. Kostikova, A. M. Fedoseev, Radiochemistry, 65:1 (2023), 39  crossref
    14. Vitaly Solov’Ev, Aslan Tsivadze, Comments on Inorganic Chemistry, 43:1 (2023), 16  crossref
    15. Yang Liu, Cong-Zhi Wang, Qun-Yan Wu, Jian-Hui Lan, Zhi-Fang Chai, Wang-Suo Wu, Wei-Qun Shi, Inorg. Chem., 2023  crossref
    16. Pin-Wen Huang, Cong-Zhi Wang, Qun-Yan Wu, Jian-Hui Lan, Zhi-Fang Chai, Wei-Qun Shi, Separation and Purification Technology, 319 (2023), 124030  crossref
    17. A. N Turanov, V. K Karandashev, O. I Artyushin, E. V Smirnova, V. K Brel, Zhurnal obschei khimii, 93:4 (2023), 577  crossref
    18. A. N Turanov, V. K Karandashev, V. A Khvostikov, V. E Baulin, D. V Baulin, Zhurnal obschei khimii, 93:8 (2023), 1274  crossref
    19. A. N. Turanov, V. K. Karandashev, V. A. Khvostikov, V. E. Baulin, D. V. Baulin, Russ J Gen Chem, 93:8 (2023), 2041  crossref
    20. A. N. Turanov, V. K. Karandashev, O. I. Artyushin, E. V. Sharova, Russ J Gen Chem, 93:11 (2023), 2805  crossref
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