Covalency in Lanthanides. An X-ray Absorption Spectroscopy and Density Functional Theory Study of LnCl6 x –x = 3, 2) MW Löble, JM Keith, AB Altman, SCE Stieber, ER Batista, KS Boland, ...
Journal of the American Chemical Society 137 (7), 2506-2523, 2015
224 2015 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 … SG Minasian, JM Keith, ER Batista, KS Boland, DL Clark, SD Conradson, ...
Journal of the American Chemical Society 134 (12), 5586-5597, 2012
215 2012 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 SA Kozimor, P Yang, ER Batista, KS Boland, CJ Burns, DL Clark, ...
Journal of the American Chemical Society 131 (34), 12125-12136, 2009
198 2009 New evidence for 5f covalency in actinocenes determined from carbon K-edge XAS and electronic structure theory SG Minasian, JM Keith, ER Batista, KS Boland, DL Clark, SA Kozimor, ...
Chemical Science 5 (1), 351-359, 2014
159 2014 Energy-degeneracy-driven covalency in actinide bonding J Su, ER Batista, KS Boland, SE Bone, JA Bradley, SK Cary, DL Clark, ...
Journal of the American Chemical Society 140 (51), 17977-17984, 2018
146 2018 Synthesis, characterization, and multielectron reduction chemistry of uranium supported by redox-active α-diimine ligands SJ Kraft, UJ Williams, SR Daly, E J. Schelter, SA Kozimor, KS Boland, ...
Inorganic chemistry 50 (20), 9838-9848, 2011
118 2011 Tetrahalide Complexes of the [U(NR)2 ]2+ Ion: Synthesis, Theory, and Chlorine K-Edge X-ray Absorption Spectroscopy LP Spencer, P Yang, SG Minasian, RE Jilek, ER Batista, KS Boland, ...
Journal of the American Chemical Society 135 (6), 2279-2290, 2013
94 2013 Synthesis and Structure of (Ph4 P)2 MCl6 (M = Ti, Zr, Hf, Th, U, Np, Pu) SG Minasian, KS Boland, RK Feller, AJ Gaunt, SA Kozimor, I May, ...
Inorganic chemistry 51 (10), 5728-5736, 2012
79 2012 Sulfur K-edge X-ray absorption spectroscopy and time-dependent density functional theory of dithiophosphinate extractants: Minor actinide selectivity and electronic structure … SR Daly, JM Keith, ER Batista, KS Boland, DL Clark, SA Kozimor, ...
Journal of the American Chemical Society 134 (35), 14408-14422, 2012
74 2012 Covalency in metal–oxygen multiple bonds evaluated using oxygen K-edge spectroscopy and electronic structure theory SG Minasian, JM Keith, ER Batista, KS Boland, JA Bradley, SR Daly, ...
Journal of the American Chemical Society 135 (5), 1864-1871, 2013
72 2013 Possible Bose-condensate behavior in a quantum phase originating in a collective excitation in the chemically and optically doped Mott-Hubbard system UO SD Conradson, T Durakiewicz, FJ Espinosa-Faller, YQ An, DA Andersson, ...
Physical Review B—Condensed Matter and Materials Physics 88 (11), 115135, 2013
55 2013 Carbon K-Edge X-ray Absorption Spectroscopy and Time-Dependent Density Functional Theory Examination of Metal–Carbon Bonding in Metallocene Dichlorides SG Minasian, JM Keith, ER Batista, KS Boland, SA Kozimor, RL Martin, ...
Journal of the American Chemical Society 135 (39), 14731-14740, 2013
54 2013 Covalency trends in group IV metallocene dichlorides. Chlorine K-edge X-ray absorption spectroscopy and time dependent-density functional theory SA Kozimor, P Yang, ER Batista, KS Boland, CJ Burns, CN Christensen, ...
Inorganic chemistry 47 (12), 5365-5371, 2008
54 2008 Probing electronic correlations in actinide materials using multipolar transitions JA Bradley, S Sen Gupta, GT Seidler, KT Moore, MW Haverkort, ...
Physical Review B—Condensed Matter and Materials Physics 81 (19), 193104, 2010
50 2010 Oxidation and Hydration of U3 O8 Materials Following Controlled Exposure to Temperature and Humidity AL Tamasi, KS Boland, K Czerwinski, JK Ellis, SA Kozimor, RL Martin, ...
Analytical chemistry 87 (8), 4210-4217, 2015
48 2015 Experimental and Theoretical Comparison of the O K-Edge Nonresonant Inelastic X-ray Scattering and X-ray Absorption Spectra of NaReO4 JA Bradley, P Yang, ER Batista, KS Boland, CJ Burns, DL Clark, ...
Journal of the American Chemical Society 132 (39), 13914-13921, 2010
43 2010 Electronic structure and O K-edge XAS spectroscopy of U3O8 XD Wen, MW Löble, ER Batista, E Bauer, KS Boland, AK Burrell, ...
Journal of electron spectroscopy and related phenomena 194, 81-87, 2014
31 2014 NMR spectroscopy and structural characterization of dithiophosphinate ligands relevant to minor actinide extraction processes SR Daly, JR Klaehn, KS Boland, SA Kozimor, MM MacInnes, ...
Dalton Transactions 41 (7), 2163-2175, 2012
31 2012 The coordination chemistry of trivalent lanthanides (Ce, Nd, Sm, Eu, Gd, Dy, Yb) with diphenyldithiophosphinate anions KS Boland, DE Hobart, SA Kozimor, MM MacInnes, BL Scott
Polyhedron 67, 540-548, 2014
24 2014 Probing Ni[S2 PR2 ]2 Electronic Structure to Generate Insight Relevant to Minor Actinide Extraction Chemistry SR Daly, JM Keith, ER Batista, KS Boland, SA Kozimor, RL Martin, ...
Inorganic chemistry 51 (14), 7551-7560, 2012
19 2012 
David L ClarkLos Alamos National LaboratoryZweryfikowany adres z lanl.gov
