Publication - Journal Article 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

Journal Article

Journal of the American Chemical Society, vol. 134, iss. 12, pp. 5586-5597, 2012

Authors

Stefan G. Minasian, Jason M. Keith, Enrique R. Batista, Kevin S. Boland, David L. Clark, Steven D. Conradson, Stosh A. Kozimor, Richard L. Martin, Daniel E. Schwarz, David K. Shuh, Gregory L. Wagner, Marianne P. Wilkerson, Laura E. Wolfsberg, Ping Yang

Language English

Publication - Journal Article Determining Relative f and d Orbital Contributions to M–Cl Covalency in MCl62– (M = Ti, Zr, Hf, U) and UOCl5– Using Cl K-Edge X-ray Absorption Spectroscopy and Time-Dependent Density Functional Theory

DOI

Publication - Journal Article 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