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  1. Article: Ultrahigh Affinity and Selectivity Nanotraps for Uranium Extraction from Seawater.

    Wang, Cong-Zhi / Chai, Zhi-Fang / Shi, Wei-Qun

    ACS central science

    2021  Volume 7, Issue 10, Page(s) 1602–1604

    Language English
    Publishing date 2021-09-30
    Publishing country United States
    Document type News
    ISSN 2374-7943
    ISSN 2374-7943
    DOI 10.1021/acscentsci.1c01118
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  2. Article ; Online: Theoretical insights into selective extraction of Am(III) from Cm(III) and Eu(III) with asymmetric N-heterocyclic ligands.

    Chen, Yan-Mei / Wang, Cong-Zhi / Zhang, Lei / Wu, Qun-Yan / Lan, Jian-Hui / Chai, Zhi-Fang / Shi, Wei-Qun

    Dalton transactions (Cambridge, England : 2003)

    2024  Volume 53, Issue 17, Page(s) 7406–7413

    Abstract: Separation of lanthanide (Ln) and minor actinide (MA) elements and mutual separation between minor actinide elements ( ...

    Abstract Separation of lanthanide (Ln) and minor actinide (MA) elements and mutual separation between minor actinide elements (
    Language English
    Publishing date 2024-04-30
    Publishing country England
    Document type Journal Article
    ZDB-ID 1472887-4
    ISSN 1477-9234 ; 1364-5447 ; 0300-9246 ; 1477-9226
    ISSN (online) 1477-9234 ; 1364-5447
    ISSN 0300-9246 ; 1477-9226
    DOI 10.1039/d3dt03965j
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  3. Article ; Online: Theoretical Insights into the Substitution Effect of Phenanthroline Derivatives on Am(III)/Eu(III) Separation.

    Lei, Xia-Ping / Wu, Qun-Yan / Wang, Cong-Zhi / Lan, Jian-Hui / Chai, Zhi-Fang / Nie, Chang-Ming / Shi, Wei-Qun

    Inorganic chemistry

    2023  Volume 62, Issue 6, Page(s) 2705–2714

    Abstract: Separation of trivalent actinides (An(III)) and lanthanides (Ln(III)) poses a huge challenge in the reprocessing of spent nuclear fuel due to their similar chemical properties. ...

    Abstract Separation of trivalent actinides (An(III)) and lanthanides (Ln(III)) poses a huge challenge in the reprocessing of spent nuclear fuel due to their similar chemical properties.
    Language English
    Publishing date 2023-02-01
    Publishing country United States
    Document type Journal Article
    ZDB-ID 1484438-2
    ISSN 1520-510X ; 0020-1669
    ISSN (online) 1520-510X
    ISSN 0020-1669
    DOI 10.1021/acs.inorgchem.2c03823
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  4. Article ; Online: Insights into the Reduction Mechanisms of Np(VI) to Np(V) by Carbohydrazide.

    Li, Xiao-Bo / Wu, Qun-Yan / Wang, Cong-Zhi / Lan, Jian-Hui / Zhang, Meng / Chai, Zhi-Fang / Shi, Wei-Qun

    The journal of physical chemistry. A

    2023  Volume 127, Issue 19, Page(s) 4259–4268

    Abstract: An efficient approach to Np separation in the Plutonium Uranium Reduction EXtraction (PUREX) process is to adjust Np(VI) to Np(V) by free-salt reductants, such as hydrazine and its derivatives. Recently, carbohydrazide (CO( ... ...

    Abstract An efficient approach to Np separation in the Plutonium Uranium Reduction EXtraction (PUREX) process is to adjust Np(VI) to Np(V) by free-salt reductants, such as hydrazine and its derivatives. Recently, carbohydrazide (CO(N
    Language English
    Publishing date 2023-05-04
    Publishing country United States
    Document type Journal Article
    ISSN 1520-5215
    ISSN (online) 1520-5215
    DOI 10.1021/acs.jpca.3c00062
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  5. Article ; Online: Unveiling the Reduction Mechanism of Pu(IV) by Acetaldoxime.

    Li, Xiao-Bo / Wu, Qun-Yan / Wang, Cong-Zhi / Lan, Jian-Hui / Zhang, Meng / Chai, Zhi-Fang / Shi, Wei-Qun

    The journal of physical chemistry. A

    2023  Volume 127, Issue 36, Page(s) 7479–7486

    Abstract: The separation of plutonium (Pu) from spent nuclear fuel was achieved by effectively adjusting the oxidation state of Pu from +IV to +III in the plutonium uranium reduction extraction (PUREX) process. Acetaldoxime ( ... ...

    Abstract The separation of plutonium (Pu) from spent nuclear fuel was achieved by effectively adjusting the oxidation state of Pu from +IV to +III in the plutonium uranium reduction extraction (PUREX) process. Acetaldoxime (CH
    Language English
    Publishing date 2023-09-05
    Publishing country United States
    Document type Journal Article
    ISSN 1520-5215
    ISSN (online) 1520-5215
    DOI 10.1021/acs.jpca.3c03830
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  6. Article ; Online: Theoretical Insights on the Complexation of Americium(III) and Europium(III) with Diglycolamide- and Dimethylacetamide-Functionalized Calix[4]arenes.

    Liu, Yang / Wang, Cong-Zhi / Wu, Qun-Yan / Lan, Jian-Hui / Chai, Zhi-Fang / Wu, Wang-Suo / Shi, Wei-Qun

    Inorganic chemistry

    2023  Volume 62, Issue 21, Page(s) 8179–8187

    Abstract: Separation of minor actinides from lanthanides is one of the biggest challenges in spent fuel reprocessing due to the similar physicochemical properties of trivalent lanthanides (Ln(III)) and actinides (An(III)). Therefore, developing ligands with ... ...

    Abstract Separation of minor actinides from lanthanides is one of the biggest challenges in spent fuel reprocessing due to the similar physicochemical properties of trivalent lanthanides (Ln(III)) and actinides (An(III)). Therefore, developing ligands with excellent extraction and separation performance is essential at present. As an excellent pre-organization platform, calixarene has received more attention on Ln(III)/An(III) separation. In this work, we systematically explored the complexation behaviors of the diglycolamide (DGA)/dimethylacetamide (DMA)-functionalized calix[4]arene extractants for Eu(III) and Am(III) using relativistic density functional theory (DFT). These calix[4]arene-derived ligands were obtained by functionalization with two or four binding units at the narrow edge of the calix[4]arene platform. All bonding nature analyses suggested that the Eu-L complexes possess stronger interaction compared to Am-L analogues, resulting in the higher extraction capacity of the these calix[4]arene ligands toward Eu(III). Thermodynamic analysis demonstrates that these pre-organized ligands on the calix[4]arene platform with four binding units yield better extraction abilities than the single ligands. Although DMA-functionalized ligands show stronger complexation stability for metal ions, in acidic solutions, the calix[4]arene ligands with DGA binding units have better extraction performance for Eu(III) and Am(III) due to the basicity of the DMA ligand. This work enabled us to gain a deeper understanding of the bonding properties between supramolecular ligands and lanthanides/actinides and afford useful insights into designing efficient supramolecular ligands for separating Ln(III)/An(III).
    Language English
    Publishing date 2023-05-16
    Publishing country United States
    Document type Journal Article
    ZDB-ID 1484438-2
    ISSN 1520-510X ; 0020-1669
    ISSN (online) 1520-510X
    ISSN 0020-1669
    DOI 10.1021/acs.inorgchem.3c00546
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  7. Article ; Online: Theoretical Insights into the Selectivity of Hydrophilic Sulfonated and Phosphorylated Ligands to Am(III) and Eu(III) Ions.

    Zou, Yao / Lan, Jian-Hui / Yuan, Li-Yong / Wang, Cong-Zhi / Wu, Qun-Yan / Chai, Zhi-Fang / Ren, Peng / Shi, Wei-Qun

    Inorganic chemistry

    2023  Volume 62, Issue 11, Page(s) 4581–4589

    Abstract: The separation of lanthanides and actinides has attracted great attention in spent nuclear fuel reprocessing up to date. In addition, liquid-liquid extraction is a feasible and useful way to separate An(III) from Ln(III) based on their relative ... ...

    Abstract The separation of lanthanides and actinides has attracted great attention in spent nuclear fuel reprocessing up to date. In addition, liquid-liquid extraction is a feasible and useful way to separate An(III) from Ln(III) based on their relative solubilities in two different immiscible liquids. The hydrophilic bipyridine- and phenanthroline-based nitrogen-chelating ligands show excellent performance in separation of Am(III) and Eu(III) as reported previously. To profoundly explore the separation mechanism, herein, we first of all designed four hydrophilic sulfonated and phosphorylated ligands L
    Language English
    Publishing date 2023-03-09
    Publishing country United States
    Document type Journal Article
    ZDB-ID 1484438-2
    ISSN 1520-510X ; 0020-1669
    ISSN (online) 1520-510X
    ISSN 0020-1669
    DOI 10.1021/acs.inorgchem.2c04476
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  8. Article ; Online: 4f/5d Hybridization Induced Single-Electron Delocalization in an Azide-Bridged Dicerium Complex.

    Guo, Yan / Jiang, Xue-Lian / Wu, Qun-Yan / Liu, Kang / Wang, Wenyuan / Hu, Kong-Qiu / Mei, Lei / Chai, Zhi-Fang / Gibson, John K / Yu, Ji-Pan / Li, Jun / Shi, Wei-Qun

    Journal of the American Chemical Society

    2024  Volume 146, Issue 10, Page(s) 7088–7096

    Abstract: Dilanthanide complexes with one-electron delocalization are important targets for understanding the specific 4f/5d-bonding feature in lanthanide chemistry. Here, we report an isolable azide-bridged dicerium ... ...

    Abstract Dilanthanide complexes with one-electron delocalization are important targets for understanding the specific 4f/5d-bonding feature in lanthanide chemistry. Here, we report an isolable azide-bridged dicerium complex
    Language English
    Publishing date 2024-03-04
    Publishing country United States
    Document type Journal Article
    ZDB-ID 3155-0
    ISSN 1520-5126 ; 0002-7863
    ISSN (online) 1520-5126
    ISSN 0002-7863
    DOI 10.1021/jacs.4c01047
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  9. Article ; Online: Encapsulation of Polymetallic Oxygen Clusters in a Mesoporous/Microporous Thorium-Based Porphyrin Metal-Organic Framework for Enhanced Photocatalytic CO

    Huang, Zhi-Wei / Hu, Kong-Qiu / Mei, Lei / Wang, De-Gao / Wang, Jing-Yang / Wu, Wang-Suo / Chai, Zhi-Fang / Shi, Wei-Qun

    Inorganic chemistry

    2022  Volume 61, Issue 8, Page(s) 3368–3373

    Abstract: Solar-initiated ... ...

    Abstract Solar-initiated CO
    Language English
    Publishing date 2022-02-14
    Publishing country United States
    Document type Journal Article
    ZDB-ID 1484438-2
    ISSN 1520-510X ; 0020-1669
    ISSN (online) 1520-510X
    ISSN 0020-1669
    DOI 10.1021/acs.inorgchem.1c04033
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  10. Article ; Online: Reduction of Np(VI) with hydrazinopropionitrile

    Li, Xiao-Bo / Wu, Qun-Yan / Wang, Cong-Zhi / Lan, Jian-Hui / Zhang, Meng / Gibson, John K / Chai, Zhi-Fang / Shi, Wei-Qun

    Physical chemistry chemical physics : PCCP

    2022  Volume 24, Issue 29, Page(s) 17782–17791

    Abstract: Effectively adjusting and controlling the valence state of neptunium (Np) is essential in its separation during spent fuel reprocessing. Hydrazine and its derivatives as free-salts can selectively reduce Np(VI) to Np(V). Reduction mechanisms of Np(VI) ... ...

    Abstract Effectively adjusting and controlling the valence state of neptunium (Np) is essential in its separation during spent fuel reprocessing. Hydrazine and its derivatives as free-salts can selectively reduce Np(VI) to Np(V). Reduction mechanisms of Np(VI) with hydrazine and four derivatives have been explored using multiple theoretical methods in our previous works. Herein, we examine the reduction mechanism of Np(VI) with hydrazinopropionitrile (NCCH
    Language English
    Publishing date 2022-07-27
    Publishing country England
    Document type Journal Article
    ZDB-ID 1476244-4
    ISSN 1463-9084 ; 1463-9076
    ISSN (online) 1463-9084
    ISSN 1463-9076
    DOI 10.1039/d2cp01730j
    Database MEDical Literature Analysis and Retrieval System OnLINE

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