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

scientific article published on 9 March 2012

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 is …
instance of (P31):
scholarly articleQ13442814

External links are
P356DOI10.1021/JA2105015
P698PubMed publication ID22404133

P50authorGregory L WagnerQ44879734
Marianne P. WilkersonQ44879788
Ping YangQ44879841
P2093author name stringDavid K Shuh
Stosh A Kozimor
David L Clark
Enrique R Batista
Richard L Martin
Jason M Keith
Stefan G Minasian
Steven D Conradson
Kevin S Boland
Laura E Wolfsberg
Daniel E Schwarz
P433issue12
P407language of work or nameEnglishQ1860
P304page(s)5586-5597
P577publication date2012-03-09
P1433published inJournal of the American Chemical SocietyQ898902
P1476titleDetermining 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
P478volume134

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