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Journal Abstract Search

130 related items for PubMed ID: 38743642

  • 1. Contemporary Assessment of Energy Degeneracy in Orbital Mixing with Tetravalent f-Block Compounds.
    Pereiro FA, Galley SS, Jackson JA, Shafer JC.
    Inorg Chem; 2024 May 27; 63(21):9687-9700. PubMed ID: 38743642
    [Abstract] [Full Text] [Related]

  • 2. On the Origin of Covalent Bonding in Heavy Actinides.
    Kelley MP, Su J, Urban M, Luckey M, Batista ER, Yang P, Shafer JC.
    J Am Chem Soc; 2017 Jul 26; 139(29):9901-9908. PubMed ID: 28657317
    [Abstract] [Full Text] [Related]

  • 3. Enhancing Actinide(III) over Lanthanide(III) Selectivity through Hard-by-Soft Donor Substitution: Exploitation and Implication of Near-Degeneracy-Driven Covalency.
    Sadhu B, Dolg M.
    Inorg Chem; 2019 Aug 05; 58(15):9738-9748. PubMed ID: 31343876
    [Abstract] [Full Text] [Related]

  • 4. Trends in covalency for d- and f-element metallocene dichlorides identified using chlorine K-edge X-ray absorption spectroscopy and time-dependent density functional theory.
    Kozimor SA, Yang P, Batista ER, Boland KS, Burns CJ, Clark DL, Conradson SD, Martin RL, Wilkerson MP, Wolfsberg LE.
    J Am Chem Soc; 2009 Sep 02; 131(34):12125-36. PubMed ID: 19705913
    [Abstract] [Full Text] [Related]

  • 5. The Counterintuitive Relationship between Orbital Energy, Orbital Overlap, and Bond Covalency in CeF62- and CeCl62.
    Branson JA, Smith PW, Sergentu DC, Russo DR, Gupta H, Booth CH, Arnold J, Schelter EJ, Autschbach J, Minasian SG.
    J Am Chem Soc; 2024 Sep 18; 146(37):25640-25655. PubMed ID: 39241121
    [Abstract] [Full Text] [Related]

  • 6. The coordination chemistry of lanthanide and actinide metal ions with hydroxypyridinone-based decorporation agents: orbital and density based analyses.
    Sadhu B, Mishra V.
    Dalton Trans; 2018 Nov 27; 47(46):16603-16615. PubMed ID: 30417921
    [Abstract] [Full Text] [Related]

  • 7. Energy-Degeneracy-Driven Covalency in Actinide Bonding.
    Su J, Batista ER, Boland KS, Bone SE, Bradley JA, Cary SK, Clark DL, Conradson SD, Ditter AS, Kaltsoyannis N, Keith JM, Kerridge A, Kozimor SA, Löble MW, Martin RL, Minasian SG, Mocko V, La Pierre HS, Seidler GT, Shuh DK, Wilkerson MP, Wolfsberg LE, Yang P.
    J Am Chem Soc; 2018 Dec 26; 140(51):17977-17984. PubMed ID: 30540455
    [Abstract] [Full Text] [Related]

  • 8. Covalency in Actinide Compounds.
    Pace KA, Klepov VV, Berseneva AA, Zur Loye HC.
    Chemistry; 2021 Apr 01; 27(19):5835-5841. PubMed ID: 33283323
    [Abstract] [Full Text] [Related]

  • 9. A computational investigation of orbital overlap versus energy degeneracy covalency in [UE2]2+ (E = O, S, Se, Te) complexes.
    Platts JA, Baker RJ.
    Dalton Trans; 2020 Jan 28; 49(4):1077-1088. PubMed ID: 31868192
    [Abstract] [Full Text] [Related]

  • 10. Determining relative f and d orbital contributions to M-Cl covalency in MCl6(2-) (M = Ti, Zr, Hf, U) and UOCl5(-) using Cl K-edge X-ray absorption spectroscopy and time-dependent density functional theory.
    Minasian SG, Keith JM, Batista ER, Boland KS, Clark DL, Conradson SD, Kozimor SA, Martin RL, Schwarz DE, Shuh DK, Wagner GL, Wilkerson MP, Wolfsberg LE, Yang P.
    J Am Chem Soc; 2012 Mar 28; 134(12):5586-97. PubMed ID: 22404133
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  • 15. Covalency in AnCl2 (An = Th-No).
    Cooper S, Kaltsoyannis N.
    Dalton Trans; 2022 Apr 12; 51(15):5929-5937. PubMed ID: 35348160
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  • 16. K- and L-edge X-ray Absorption Spectroscopy (XAS) and Resonant Inelastic X-ray Scattering (RIXS) Determination of Differential Orbital Covalency (DOC) of Transition Metal Sites.
    Baker ML, Mara MW, Yan JJ, Hodgson KO, Hedman B, Solomon EI.
    Coord Chem Rev; 2017 Aug 15; 345():182-208. PubMed ID: 28970624
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  • 18. Periodic trends and complexation chemistry of tetravalent actinide ions with a potential actinide decorporation agent 5-LIO(Me-3,2-HOPO): A relativistic density functional theory exploration.
    Sadhu B, Dolg M, Kulkarni MS.
    J Comput Chem; 2020 Jun 05; 41(15):1427-1435. PubMed ID: 32125003
    [Abstract] [Full Text] [Related]

  • 19. Quantitative Evidence for Lanthanide-Oxygen Orbital Mixing in CeO2, PrO2, and TbO2.
    Minasian SG, Batista ER, Booth CH, Clark DL, Keith JM, Kozimor SA, Lukens WW, Martin RL, Shuh DK, Stieber SCE, Tylisczcak T, Wen XD.
    J Am Chem Soc; 2017 Dec 13; 139(49):18052-18064. PubMed ID: 29182343
    [Abstract] [Full Text] [Related]

  • 20. Computational and Spectroscopic Tools for the Detection of Bond Covalency in Pu(IV) Materials.
    Bagus PS, Schacherl B, Vitova T.
    Inorg Chem; 2021 Nov 01; 60(21):16090-16102. PubMed ID: 34634201
    [Abstract] [Full Text] [Related]

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