Quantitative Evidence for Lanthanide-Oxygen Orbital Mixing in CeO2, PrO2, and TbO2

Minasian, Stefan G.; Batista, Enrique R.; Booth, Corwin H.; Clark, David L.; Keith, Jason M.; Kozimor, Stosh A.; Lukens, Wayne W.; Martin, Richard L.; Shuh, David K.; Stieber, S. Chantal E.; Tylisczcak, Tolek; Wen, Xiao-dong

doi:10.1021/jacs.7b10361

Title: Quantitative Evidence for Lanthanide-Oxygen Orbital Mixing in CeO₂, PrO₂, and TbO₂

Journal Article · Tue Nov 28 00:00:00 EST 2017 · Journal of the American Chemical Society

DOI:https://doi.org/10.1021/jacs.7b10361· OSTI ID:1485070

^[1];

^[2]; Booth, Corwin H. ^[1]; Clark, David L. ^[2]; Keith, Jason M. ^[3]; Kozimor, Stosh A. ^[2];

^[1]; Martin, Richard L. ^[2]; Shuh, David K. ^[1];

^[4]; Tylisczcak, Tolek ^[1]; Wen, Xiao-dong ^[5]

Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)
Los Alamos National Lab. (LANL), Los Alamos, NM (United States)
Colgate University, Hamilton, NY (United States)
California State Polytechnic University, Pomona, CA (United States)
Chinese Academy of Sciences, Taiyuan (China)

We report that understanding the nature of covalent (band-like) vs ionic (atomic-like) electrons in metal oxides continues to be at the forefront of research in the physical sciences. In particular, the development of a coherent and quantitative model of bonding and electronic structure for the lanthanide dioxides, LnO₂ (Ln = Ce, Pr, and Tb), has remained a considerable challenge for both experiment and theory. Herein, relative changes in mixing between the O 2p orbitals and the Ln 4f and 5d orbitals in LnO₂ are evaluated quantitatively using O K-edge X-ray absorption spectroscopy (XAS) obtained with a scanning transmission X-ray microscope and density functional theory (DFT) calculations. For each LnO₂, the results reveal significant amounts of Ln 5d and O 2p mixing in the orbitals of t_2g (σ-bonding) and e_g (π-bonding) symmetry. The remarkable agreement between experiment and theory also shows that significant mixing with the O 2p orbitals occurs in a band derived from the 4f orbitals of a_2u symmetry (σ-bonding) for each compound. However, a large increase in orbital mixing is observed for PrO₂ that is ascribed to a unique interaction derived from the 4f orbitals of t_1u symmetry (σ- and π-bonding). Lastly, O K-edge XAS and DFT results are compared with complementary L₃-edge and M_5,4-edge XAS measurements and configuration interaction calculations, which shows that each spectroscopic approach provides evidence for ground state O 2p and Ln 4f orbital mixing despite inducing very different core-hole potentials in the final state.

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Research Organization:: Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES); USDOE National Nuclear Security Administration (NNSA)

Grant/Contract Number:: AC02-05CH11231; AC52-06NA25396; AC02-76SF00515

OSTI ID:: 1485070

Journal Information:: Journal of the American Chemical Society, Vol. 139, Issue 49; ISSN 0002-7863

Publisher:: American Chemical Society (ACS)Copyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 66 works

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References (138)

A Three-Pronged Attack To Investigate the Electronic Structure of a Family of Ferromagnetic Fe ₄ Ln ₂ Cyclic Coordination Clusters: A Combined Magnetic Susceptibility, High-Field/High-Frequency Electron Paramagnetic Resonance, and ⁵⁷ Fe Mössbauer Study Schmidt, Sebastian F. M.; Koo, Changhyun; Mereacre, Valeriu Inorganic Chemistry, Vol. 56, Issue 9 https://doi.org/10.1021/acs.inorgchem.6b02682	journal	February 2017
Investigation into the Effects of a Trigonal-Planar Ligand Field on the Electronic Properties of Lanthanide(II) Tris(silylamide) Complexes (Ln = Sm, Eu, Tm, Yb) Goodwin, Conrad A. P.; Chilton, Nicholas F.; Natrajan, Louise S. Inorganic Chemistry, Vol. 56, Issue 10 https://doi.org/10.1021/acs.inorgchem.7b00664	journal	April 2017
Rare earth separations by selective borate crystallization Yin, Xuemiao; Wang, Yaxing; Bai, Xiaojing Nature Communications, Vol. 8, Issue 1 https://doi.org/10.1038/ncomms14438	journal	March 2017
The roles of 4f- and 5f-orbitals in bonding: a magnetochemical, crystal field, density functional theory, and multi-reference wavefunction study Lukens, W. W.; Speldrich, M.; Yang, P. Dalton Transactions, Vol. 45, Issue 28 https://doi.org/10.1039/C6DT00634E	journal	January 2016
Tuning Magnetism of [MnSb ₄ ] ^9– Cluster in Yb ₁₄ MnSb ₁₁ through Chemical Substitutions on Yb Sites: Appearance and Disappearance of Spin Reorientation Hu, Yufei; Chen, Chih-Wei; Cao, Huibo Journal of the American Chemical Society, Vol. 138, Issue 38 https://doi.org/10.1021/jacs.6b05636	journal	September 2016
Europium chalcogenide magnetic semiconductor nanostructures Boncher, William; Dalafu, Haydee; Rosa, Nicholas Coordination Chemistry Reviews, Vol. 289-290 https://doi.org/10.1016/j.ccr.2014.12.008	journal	April 2015
Templating Influence of Molecular Precursors on Pr(OH) ₃ Nanostructures Hemmer, Eva; Cavelius, Christian; Huch, Volker Inorganic Chemistry, Vol. 54, Issue 13 https://doi.org/10.1021/acs.inorgchem.5b00529	journal	June 2015
Ultrathin Europium Oxide Nanoplatelets: “Hidden” Parameters and Controlled Synthesis, Unusual Crystal Structure, and Photoluminescence Properties Hudry, D.; Abeykoon, A. M. M.; Hoy, J. Chemistry of Materials, Vol. 27, Issue 3 https://doi.org/10.1021/cm504255y	journal	January 2015
Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE ₂ Cu(TeO ₃ ) ₂ (SO ₄ ) ₂ Lin, Jian; Chai, Ping; Diefenbach, Kariem Chemistry of Materials, Vol. 26, Issue 6 https://doi.org/10.1021/cm500252q	journal	March 2014
Understanding and prediction of electronic-structure-driven physical behaviors in rare-earth compounds Paudyal, Durga; Pathak, Arjun K.; Pecharsky, V. K. Journal of Physics: Condensed Matter, Vol. 25, Issue 39 https://doi.org/10.1088/0953-8984/25/39/396002	journal	September 2013
Oxo-Functionalization and Reduction of the Uranyl Ion through Lanthanide-Element Bond Homolysis: Synthetic, Structural, and Bonding Analysis of a Series of Singly Reduced Uranyl–Rare Earth 5f ¹ -4f ⁿ Complexes Arnold, Polly L.; Hollis, Emmalina; Nichol, Gary S. Journal of the American Chemical Society, Vol. 135, Issue 10 https://doi.org/10.1021/ja308993g	journal	March 2013
Lanthanide N , N -Dimethylaminodiboranates as a New Class of Highly Volatile Chemical Vapor Deposition Precursors Daly, Scott R.; Kim, Do Young; Girolami, Gregory S. Inorganic Chemistry, Vol. 51, Issue 13 https://doi.org/10.1021/ic201852j	journal	June 2012
Computational Study of Cation Diffusion in Ceria Beschnitt, Stefan; Zacherle, Tobias; De Souza, Roger A. The Journal of Physical Chemistry C, Vol. 119, Issue 49 https://doi.org/10.1021/acs.jpcc.5b09499	journal	November 2015
Redox behavior of a low-doped Pr-CeO2(111) surface. A DFT+U study Milberg, Brian; Juan, Alfredo; Irigoyen, Beatriz Applied Surface Science, Vol. 401 https://doi.org/10.1016/j.apsusc.2016.12.245	journal	April 2017
Three-dimensionally ordered macroporous Pr6O11 and Tb4O7 with mesoporous walls: Preparation, characterization, and catalytic activity for CO oxidation Zhang, Yujuan; Deng, Jiguang; Zhang, Han Catalysis Today, Vol. 245 https://doi.org/10.1016/j.cattod.2014.09.017	journal	May 2015
Nanostructured Praseodymium Oxide: Correlation Between Phase Transitions and Catalytic Activity Sonström, Patrick; Birkenstock, Johannes; Borchert, Yulia ChemCatChem, Vol. 2, Issue 6 https://doi.org/10.1002/cctc.200900311	journal	June 2010
Oxygen buffering capacity of mixed cerium terbium oxide: a new material with potential applications in three-way catalysts Bernal, Serafín; Blanco, Ginesa; Cauqui, Miguel A. Chemical Communications, Issue 16 https://doi.org/10.1039/a702617j	journal	January 1997
Fundamentals and Catalytic Applications of CeO ₂ -Based Materials Montini, Tiziano; Melchionna, Michele; Monai, Matteo Chemical Reviews, Vol. 116, Issue 10 https://doi.org/10.1021/acs.chemrev.5b00603	journal	April 2016
Giant onsite electronic entropy enhances the performance of ceria for water splitting Naghavi, S. Shahab; Emery, Antoine A.; Hansen, Heine A. Nature Communications, Vol. 8, Issue 1 https://doi.org/10.1038/s41467-017-00381-2	journal	August 2017
Facile hydrothermal synthesis of a highly efficient solar active Pr ₆ O ₁₁ –ZnO photocatalyst and its multiple applications Balachandran, Subramanian; Thirumalai, Kuppulingam; Swaminathan, Meenakshisundaram RSC Adv., Vol. 4, Issue 53 https://doi.org/10.1039/C4RA02733G	journal	January 2014
Monodisperse CeO ₂ Nanoparticles and Their Oxygen Storage and Release Properties Imagawa, Haruo; Suda, Akihiko; Yamamura, Kae The Journal of Physical Chemistry C, Vol. 115, Issue 5 https://doi.org/10.1021/jp109878j	journal	December 2010
Direct modeling of the electrochemistry in the three-phase boundary of solid oxide fuel cell anodes by density functional theory: a critical overview Shishkin, M.; Ziegler, T. Phys. Chem. Chem. Phys., Vol. 16, Issue 5 https://doi.org/10.1039/C3CP53943A	journal	January 2014
Theoretical study of CeO2 and Ce2O3 using a screened hybrid density functional Hay, P. Jeffrey; Martin, Richard L.; Uddin, Jamal The Journal of Chemical Physics, Vol. 125, Issue 3 https://doi.org/10.1063/1.2206184	journal	July 2006
Modeling of $Ce O_{2}$ , ${Ce}_{2} O_{3}$ , and $Ce O_{2 - x}$ in the $LDA + U$ formalism Andersson, D. A.; Simak, S. I.; Johansson, B. Physical Review B, Vol. 75, Issue 3 https://doi.org/10.1103/PhysRevB.75.035109	journal	January 2007
$PBE + U$ calculations of the Jahn-Teller effect in $\Pr O_{2}$ Tran, Fabien; Schweifer, Johannes; Blaha, Peter Physical Review B, Vol. 77, Issue 8 https://doi.org/10.1103/PhysRevB.77.085123	journal	February 2008
Localized and Itinerant States in Lanthanide Oxides United by $G W @ LDA + U$ Jiang, Hong; Gomez-Abal, Ricardo I.; Rinke, Patrick Physical Review Letters, Vol. 102, Issue 12 https://doi.org/10.1103/PhysRevLett.102.126403	journal	March 2009
Nature of the electronic band gap in lanthanide oxides Gillen, Roland; Clark, Stewart J.; Robertson, John Physical Review B, Vol. 87, Issue 12 https://doi.org/10.1103/PhysRevB.87.125116	journal	March 2013
Specific intermediate-valence state of insulating 4 f compounds detected by $L_{3}$ x-ray absorption Bianconi, A.; Marcelli, A.; Dexpert, H. Physical Review B, Vol. 35, Issue 2 https://doi.org/10.1103/PhysRevB.35.806	journal	January 1987
X-ray absorption studies of ${CeO}_{2}$ , ${PrO}_{2}$ , and ${TbO}_{2}$ . II. Rare-earth valence state by $L_{III}$ absorption edges Dexpert, H.; Karnatak, R. C.; Esteva, J. -M. Physical Review B, Vol. 36, Issue 3 https://doi.org/10.1103/PhysRevB.36.1750	journal	July 1987
Pressure-induced changes in $L_{III}$ x-ray-absorption near-edge structure of Ce $O_{2}$ and Ce $F_{4}$ : Relevance to $4 f$ -electronic structure Kaindl, G.; Schmiester, G.; Sampathkumaran, E. V. Physical Review B, Vol. 38, Issue 14 https://doi.org/10.1103/PhysRevB.38.10174	journal	November 1988
A new method of directly determining the core–hole effect in the Ce L3 XAS of mixed valence Ce compounds—An application of resonant X-ray emission spectroscopy Kotani, A.; Kvashnina, K. O.; Butorin, S. M. Journal of Electron Spectroscopy and Related Phenomena, Vol. 184, Issue 3-6 https://doi.org/10.1016/j.elspec.2010.12.028	journal	April 2011
M ‐edge x‐ray absorption spectroscopy of 4 f instabilities in rare‐earth systems (invited) Kaindl, G.; Kalkowski, G.; Brewer, W. D. Journal of Applied Physics, Vol. 55, Issue 6 https://doi.org/10.1063/1.333517	journal	March 1984
Theory of core-level spectroscopy of rare-earth oxides Kotani, Akio; Ogasawara, Haruhiko Journal of Electron Spectroscopy and Related Phenomena, Vol. 60, Issue 4 https://doi.org/10.1016/0368-2048(92)80024-3	journal	December 1992
Formation of a Ce(IV) Oxo Complex via Inner Sphere Nitrate Reduction Damon, Peter L.; Wu, Guang; Kaltsoyannis, Nikolas Journal of the American Chemical Society, Vol. 138, Issue 39 https://doi.org/10.1021/jacs.6b07932	journal	September 2016
Structural, Spectroscopic, and Theoretical Comparison of Traditional vs Recently Discovered Ln ²⁺ Ions in the [K(2.2.2-cryptand)][(C ₅ H ₄ SiMe ₃ ) ₃ Ln] Complexes: The Variable Nature of Dy ²⁺ and Nd ²⁺ Fieser, Megan E.; MacDonald, Matthew R.; Krull, Brandon T. Journal of the American Chemical Society, Vol. 137, Issue 1 https://doi.org/10.1021/ja510831n	journal	December 2014
Ligand Effects in the Synthesis of Ln ²⁺ Complexes by Reduction of Tris(cyclopentadienyl) Precursors Including C–H Bond Activation of an Indenyl Anion Corbey, Jordan F.; Woen, David H.; Palumbo, Chad T. Organometallics, Vol. 34, Issue 15 https://doi.org/10.1021/acs.organomet.5b00500	journal	May 2015
Controlled Redox Chemistry at Cerium within a Tripodal Nitroxide Ligand Framework Bogart, Justin A.; Lippincott, Connor A.; Carroll, Patrick J. Chemistry - A European Journal, Vol. 21, Issue 49 https://doi.org/10.1002/chem.201502952	journal	October 2015
Lanthanide amidinates and guanidinates in catalysis and materials science: a continuing success story Edelmann, Frank T. Chemical Society Reviews, Vol. 41, Issue 23 https://doi.org/10.1039/c2cs35180c	journal	January 2012
f-Element-Metal Bonding and the Use of the Bond Polarity To Build Molecular Intermetalloids Oelkers, Benjamin; Butovskii, Mikhail V.; Kempe, Rhett Chemistry - A European Journal, Vol. 18, Issue 43 https://doi.org/10.1002/chem.201200783	journal	September 2012
Single-Electron Uranyl Reduction by a Rare-Earth Cation Arnold, Polly L.; Hollis, Emmalina; White, Fraser J. Angewandte Chemie International Edition, Vol. 50, Issue 4 https://doi.org/10.1002/anie.201005511	journal	December 2010
Comparative Study of f-Element Electronic Structure across a Series of Multimetallic Actinide and Lanthanoid-Actinide Complexes Possessing Redox-Active Bridging Ligands Schelter, Eric J.; Wu, Ruilian; Veauthier, Jacqueline M. Inorganic Chemistry, Vol. 49, Issue 4 https://doi.org/10.1021/ic9024475	journal	February 2010
Organo-f-element bonding energetics. Large magnitudes of metal arene bond enthalpies in zero-valent lanthanide sandwich complexes King, Wayne A.; Marks, Tobin J.; Anderson, David M. Journal of the American Chemical Society, Vol. 114, Issue 23 https://doi.org/10.1021/ja00049a084	journal	November 1992
Pursuit of Record Breaking Energy Barriers: A Study of Magnetic Axiality in Diamide Ligated Dy ^III Single-Molecule Magnets Harriman, Katie L. M.; Brosmer, Jonathan L.; Ungur, Liviu Journal of the American Chemical Society, Vol. 139, Issue 4 https://doi.org/10.1021/jacs.6b12374	journal	January 2017
A Low-Symmetry Dysprosium Metallocene Single-Molecule Magnet with a High Anisotropy Barrier Pugh, Thomas; Chilton, Nicholas F.; Layfield, Richard A. Angewandte Chemie International Edition, Vol. 55, Issue 37 https://doi.org/10.1002/anie.201604346	journal	July 2016
Tetranuclear and Pentanuclear Compounds of the Rare-Earth Metals: Synthesis and Magnetism Yadav, Munendra; Mondal, Abhishake; Mereacre, Valeriu Inorganic Chemistry, Vol. 54, Issue 16 https://doi.org/10.1021/acs.inorgchem.5b00899	journal	July 2015
Record High Single-Ion Magnetic Moments Through 4f ⁿ 5d ¹ Electron Configurations in the Divalent Lanthanide Complexes [(C ₅ H ₄ SiMe ₃ ) ₃ Ln] ⁻ Meihaus, Katie R.; Fieser, Megan E.; Corbey, Jordan F. Journal of the American Chemical Society, Vol. 137, Issue 31 https://doi.org/10.1021/jacs.5b03710	journal	July 2015
Tetraanionic Biphenyl Lanthanide Complexes as Single-Molecule Magnets Huang, Wenliang; Le Roy, Jennifer J.; Khan, Saeed I. Inorganic Chemistry, Vol. 54, Issue 5 https://doi.org/10.1021/ic5029788	journal	February 2015
Fine-tuning the Local Symmetry to Attain Record Blocking Temperature and Magnetic Remanence in a Single-Ion Magnet Ungur, Liviu; Le Roy, Jennifer J.; Korobkov, Ilia Angewandte Chemie International Edition, Vol. 53, Issue 17 https://doi.org/10.1002/anie.201310451	journal	March 2014
Exchange coupling and magnetic blocking in dilanthanide complexes bridged by the multi-electron redox-active ligand 2,3,5,6-tetra(2-pyridyl)pyrazine Demir, Selvan; Nippe, Michael; Gonzalez, Miguel I. Chem. Sci., Vol. 5, Issue 12 https://doi.org/10.1039/C4SC02154A	journal	January 2014
Evidence for 5d-σ and 5d-π covalency in lanthanide sesquioxides from oxygen K-edge X-ray absorption spectroscopy Altman, Alison B.; Pacold, Joseph I.; Wang, Jian Dalton Transactions, Vol. 45, Issue 24 https://doi.org/10.1039/C6DT00358C	journal	January 2016
Covalency in Lanthanides. An X-ray Absorption Spectroscopy and Density Functional Theory Study of LnCl ₆ ^{x –} ( x = 3, 2) Löble, Matthias W.; Keith, Jason M.; Altman, Alison B. Journal of the American Chemical Society, Vol. 137, Issue 7 https://doi.org/10.1021/ja510067v	journal	February 2015
Direct Observation of 4f Intrashell Excitation in Luminescent Eu Complexes by Time-Resolved X-ray Absorption Near Edge Spectroscopy Pacold, Joseph I.; Tatum, David S.; Seidler, Gerald T. Journal of the American Chemical Society, Vol. 136, Issue 11 https://doi.org/10.1021/ja407924m	journal	March 2014
Influence of the Torsion Angle in 3,3′-Dimethyl-2,2′-bipyridine on the Intermediate Valence of Yb in (C ₅ Me ₅ ) ₂ Yb(3,3′-Me ₂ -bipy) Nocton, Grégory; Booth, Corwin H.; Maron, Laurent Organometallics, Vol. 32, Issue 19 https://doi.org/10.1021/om400528d	journal	September 2013
Direct study of the f-electron configuration in lanthanide systems Kvashnina, Kristina O.; Butorin, Sergei M.; Glatzel, Pieter Journal of Analytical Atomic Spectrometry, Vol. 26, Issue 6 https://doi.org/10.1039/c0ja00142b	journal	January 2011
Low-energy spectrum of a Tm-based double-decker complex Magnani, N.; Caciuffo, R.; Colineau, E. Physical Review B, Vol. 79, Issue 10 https://doi.org/10.1103/PhysRevB.79.104407	journal	March 2009
Self-Contained Kondo Effect in Single Molecules Booth, C. H.; Walter, M. D.; Daniel, M. Physical Review Letters, Vol. 95, Issue 26 https://doi.org/10.1103/PhysRevLett.95.267202	journal	December 2005
Electronic Structure and Properties of Berkelium Iodates Silver, Mark A.; Cary, Samantha K.; Garza, Alejandro J. Journal of the American Chemical Society, Vol. 139, Issue 38 https://doi.org/10.1021/jacs.7b05569	journal	September 2017
Ab Initio Ligand-Field Theory Analysis and Covalency Trends in Actinide and Lanthanide Free Ions and Octahedral Complexes Jung, Julie; Atanasov, Mihail; Neese, Frank Inorganic Chemistry, Vol. 56, Issue 15 https://doi.org/10.1021/acs.inorgchem.7b00642	journal	July 2017
Covalent Lanthanide Chemistry Near the Limit of Weak Bonding: Observation of (CpSiMe ₃ ) ₃ Ce−ECp* and a Comprehensive Density Functional Theory Analysis of Cp ₃ Ln−ECp (E = Al, Ga) Krinsky, Jamin L.; Minasian, Stefan G.; Arnold, John Inorganic Chemistry, Vol. 50, Issue 1 https://doi.org/10.1021/ic102028d	journal	January 2011
Infrared Spectra and Quantum Chemical Calculations of the Bridge-Bonded HC(F)LnF ₂ (Ln = La–Lu) Complexes Gong, Yu; Wang, Xuefeng; Andrews, Lester Organometallics, Vol. 30, Issue 16 https://doi.org/10.1021/om200533q	journal	August 2011
All-electron CASPT2 study of Ce(η8–C8H6)2 Kerridge, Andrew; Kaltsoyannis, Nikolas Comptes Rendus Chimie, Vol. 13, Issue 6-7 https://doi.org/10.1016/j.crci.2010.02.006	journal	June 2010
First-principles $LDA + U$ and $GGA + U$ study of cerium oxides: Dependence on the effective U parameter Loschen, Christoph; Carrasco, Javier; Neyman, Konstantin M. Physical Review B, Vol. 75, Issue 3 https://doi.org/10.1103/PhysRevB.75.035115	journal	January 2007
Simple rules for determining valencies of f-electron systems Petit, L.; Svane, A.; Szotek, Z. Journal of Physics: Condensed Matter, Vol. 13, Issue 38 https://doi.org/10.1088/0953-8984/13/38/311	journal	September 2001
A Tetravalent Cerium Complex Containing a CeO Bond So, Yat-Ming; Wang, Guo-Cang; Li, Yang Angewandte Chemie International Edition, Vol. 53, Issue 6 https://doi.org/10.1002/anie.201309764	journal	January 2014
Probing the Reactivity of the Ce═O Multiple Bond in a Cerium(IV) Oxo Complex So, Yat-Ming; Li, Yang; Au-Yeung, Ka-Chun Inorganic Chemistry, Vol. 55, Issue 20 https://doi.org/10.1021/acs.inorgchem.6b00480	journal	May 2016
The First Example of a μ 2 -Imido Functionality Bound to a Lanthanide Metal Center: X-ray Crystal Structure and DFT Study of [(μ-ArN)Sm(μ-NHAr)(μ-Me)AlMe 2 ] 2 (Ar = 2,6- i Pr 2 C 6 H 3 ) 1 Gordon, John C.; Giesbrecht, Garth R.; Clark, David L. Organometallics, Vol. 21, Issue 22 https://doi.org/10.1021/om0206960	journal	October 2002
Rare-Earth Metal Complexes with Terminal Imido Ligands: Rare-Earth Metal Complexes with Terminal Imido Ligands Schädle, Dorothea; Meermann-Zimmermann, Melanie; Schädle, Christoph European Journal of Inorganic Chemistry, Vol. 2015, Issue 8 https://doi.org/10.1002/ejic.201500045	journal	February 2015
Cerium(IV) Imido Complexes: Structural, Computational, and Reactivity Studies Solola, Lukman A.; Zabula, Alexander V.; Dorfner, Walter L. Journal of the American Chemical Society, Vol. 139, Issue 6 https://doi.org/10.1021/jacs.6b12369	journal	February 2017
An Alkali Metal-Capped Cerium(IV) Imido Complex Solola, Lukman A.; Zabula, Alexander V.; Dorfner, Walter L. Journal of the American Chemical Society, Vol. 138, Issue 22 https://doi.org/10.1021/jacs.6b03293	journal	May 2016
Lewis Acid Stabilized Methylidene and Oxoscandium Complexes Scott, Jennifer; Fan, Hongjun; Wicker, Benjamin F. Journal of the American Chemical Society, Vol. 130, Issue 44 https://doi.org/10.1021/ja806635x	journal	October 2008
Spot the difference Mindiola, Daniel J.; Scott, Jennifer Nature Chemistry, Vol. 3, Issue 1 https://doi.org/10.1038/nchem.940	journal	December 2010
Emergence of comparable covalency in isostructural cerium( iv )– and uranium( iv )–carbon multiple bonds Gregson, Matthew; Lu, Erli; Tuna, Floriana Chemical Science, Vol. 7, Issue 5 https://doi.org/10.1039/C6SC00278A	journal	January 2016
The inverse-trans-influence in tetravalent lanthanide and actinide bis(carbene) complexes Gregson, Matthew; Lu, Erli; Mills, David P. Nature Communications, Vol. 8, Issue 1 https://doi.org/10.1038/ncomms14137	journal	February 2017
A Lanthanide Phosphinidene Complex: Synthesis, Structure, and Phospha-Wittig Reactivity Masuda, Jason D.; Jantunen, Kimberly C.; Ozerov, Oleg V. Journal of the American Chemical Society, Vol. 130, Issue 8 https://doi.org/10.1021/ja7105306	journal	February 2008
Complexes containing multiple bonding interactions between lanthanoid elements and main-group fragments Summerscales, Owen T.; Gordon, John C. RSC Advances, Vol. 3, Issue 19 https://doi.org/10.1039/c3ra23151h	journal	January 2013
Electronic structures of trans-dioxometal complexes Hummel, Patrick; Winkler, Jay R.; Gray, Harry B. Dalton Trans., Issue 1 https://doi.org/10.1039/B512299F	journal	January 2006
Covalency in the uranyl ion: A polarized x-ray spectroscopic study Denning, R. G.; Green, J. C.; Hutchings, T. E. The Journal of Chemical Physics, Vol. 117, Issue 17 https://doi.org/10.1063/1.1510445	journal	November 2002
Covalency in f-element complexes Neidig, Michael L.; Clark, David L.; Martin, Richard L. Coordination Chemistry Reviews, Vol. 257, Issue 2 https://doi.org/10.1016/j.ccr.2012.04.029	journal	January 2013
Tetrahalide Complexes of the [U(NR) ₂ ] ²⁺ Ion: Synthesis, Theory, and Chlorine K-Edge X-ray Absorption Spectroscopy Spencer, Liam P.; Yang, Ping; Minasian, Stefan G. Journal of the American Chemical Society, Vol. 135, Issue 6 https://doi.org/10.1021/ja310575j	journal	January 2013
Elucidating bonding preferences in tetrakis(imido)uranate(VI) dianions Anderson, Nickolas H.; Xie, Jing; Ray, Debmalya Nature Chemistry, Vol. 9, Issue 9 https://doi.org/10.1038/nchem.2767	journal	April 2017
Evidence for the Existence of Group 3 Terminal Methylidene Complexes Levine, Daniel S.; Tilley, T. Don; Andersen, Richard A. Organometallics, Vol. 36, Issue 1 https://doi.org/10.1021/acs.organomet.6b00394	journal	July 2016
Ligand K-edge X-ray absorption spectroscopy: covalency of ligand–metal bonds Solomon, Edward I.; Hedman, Britt; Hodgson, Keith O. Coordination Chemistry Reviews, Vol. 249, Issue 1-2 https://doi.org/10.1016/j.ccr.2004.03.020	journal	January 2005
Metal and Ligand K-Edge XAS of Organotitanium Complexes: Metal 4p and 3d Contributions to Pre-edge Intensity and Their Contributions to Bonding DeBeer George, Serena; Brant, Patrick; Solomon, Edward I. Journal of the American Chemical Society, Vol. 127, Issue 2 https://doi.org/10.1021/ja044827v	journal	January 2005
Relationship between the Dipole Strength of Ligand Pre-Edge Transitions and Metal−Ligand Covalency Neese, Frank; Hedman, Britt; Hodgson, Keith O. Inorganic Chemistry, Vol. 38, Issue 21 https://doi.org/10.1021/ic990461p	journal	October 1999
Ligand K-edge x-ray absorption spectroscopic studies: metal-ligand covalency in a series of transition metal tetrachlorides Shadle, Susan E.; Hedman, Britt; Hodgson, Keith O. Journal of the American Chemical Society, Vol. 117, Issue 8 https://doi.org/10.1021/ja00113a015	journal	March 1995
Determining Relative f and d Orbital Contributions to M–Cl Covalency in MCl ₆ ^2– (M = Ti, Zr, Hf, U) and UOCl ₅ ^– Using Cl K-Edge X-ray Absorption Spectroscopy and Time-Dependent Density Functional Theory Minasian, Stefan G.; Keith, Jason M.; Batista, Enrique R. Journal of the American Chemical Society, Vol. 134, Issue 12 https://doi.org/10.1021/ja2105015	journal	March 2012
New evidence for 5f covalency in actinocenes determined from carbon K-edge XAS and electronic structure theory Minasian, Stefan G.; Keith, Jason M.; Batista, Enrique R. Chem. Sci., Vol. 5, Issue 1 https://doi.org/10.1039/C3SC52030G	journal	January 2014
Covalency in Metal–Oxygen Multiple Bonds Evaluated Using Oxygen K-edge Spectroscopy and Electronic Structure Theory Minasian, Stefan G.; Keith, Jason M.; Batista, Enrique R. Journal of the American Chemical Society, Vol. 135, Issue 5 https://doi.org/10.1021/ja310223b	journal	January 2013
Experimental and Theoretical Comparison of the O K-Edge Nonresonant Inelastic X-ray Scattering and X-ray Absorption Spectra of NaReO ₄ Bradley, Joseph A.; Yang, Ping; Batista, Enrique R. Journal of the American Chemical Society, Vol. 132, Issue 39 https://doi.org/10.1021/ja1040978	journal	October 2010
Preparation, crystalline properties and X-ray absorption spectra of rare earth oxides ROx (R ≡ Ce, PrandTb; 1.5 ⩽ x ⩽ 2) Gasgnier, M.; Schiffmacher, G.; Albert, L. Journal of the Less Common Metals, Vol. 156, Issue 1-2 https://doi.org/10.1016/0022-5088(89)90407-4	journal	December 1989
Spectator and participator processes in the resonant photon-in and photon-out spectra at the Ce L3 edge of CeO2 Kotani, A.; Kvashnina, K. O.; Butorin, S. M. The European Physical Journal B, Vol. 85, Issue 8 https://doi.org/10.1140/epjb/e2012-30079-1	journal	July 2012
Effect of valence mixing on multiplet structure in core photoabsorption spectra for Ce compounds Jo, T.; Kotani, A. Physical Review B, Vol. 38, Issue 1 https://doi.org/10.1103/PhysRevB.38.830	journal	July 1988
3d x-ray-absorption lines and the 3 $d^{9}$ 4 $f^{n + 1}$ multiplets of the lanthanides Thole, B. T.; van der Laan, G.; Fuggle, J. C. Physical Review B, Vol. 32, Issue 8 https://doi.org/10.1103/PhysRevB.32.5107	journal	October 1985
A Macrocyclic Chelator That Selectively Binds Ln ⁴⁺ over Ln ³⁺ by a Factor of 10 ²⁹ Pham, Tiffany A.; Altman, Alison B.; Stieber, S. Chantal E. Inorganic Chemistry, Vol. 55, Issue 20 https://doi.org/10.1021/acs.inorgchem.6b00684	journal	June 2016
Particle-hole cumulant approach for inelastic losses in x-ray spectra Kas, J. J.; Rehr, J. J.; Curtis, J. B. Physical Review B, Vol. 94, Issue 3 https://doi.org/10.1103/PhysRevB.94.035156	journal	July 2016
CORE-HOLE EFFECT IN THE Ce L ₃ X-RAY ABSORPTION SPECTRA OF CeO ₂ AND CeFe ₂ : NEW EXAMINATION BY USING RESONANT X-RAY EMISSION SPECTROSCOPY Kotani, A. Modern Physics Letters B, Vol. 27, Issue 16 https://doi.org/10.1142/S0217984913300123	journal	June 2013
Resonant inelastic x-ray scattering at the Ce $L_{3}$ edge of ${CePO}_{4}$ and ${CeO}_{2}$ : Implications for the valence of ${CeO}_{2}$ and related phenomena Sham, T. K.; Gordon, R. A.; Heald, S. M. Physical Review B, Vol. 72, Issue 3 https://doi.org/10.1103/PhysRevB.72.035113	journal	July 2005
Total and partial atomic-level widths Keski-Rahkonen, Olavi; Krause, Manfred O. Atomic Data and Nuclear Data Tables, Vol. 14, Issue 2 https://doi.org/10.1016/S0092-640X(74)80020-3	journal	August 1974
Influence of Pyrazolate vs N -Heterocyclic Carbene Ligands on the Slow Magnetic Relaxation of Homoleptic Trischelate Lanthanide(III) and Uranium(III) Complexes Meihaus, Katie R.; Minasian, Stefan G.; Lukens, Wayne W. Journal of the American Chemical Society, Vol. 136, Issue 16 https://doi.org/10.1021/ja501569t	journal	April 2014
Quantitative electron energy loss spectroscopy on M45 edges in rare earth oxides Manoubi, T.; Colliex, C.; Rez, P. Journal of Electron Spectroscopy and Related Phenomena, Vol. 50, Issue 1 https://doi.org/10.1016/0368-2048(90)80001-Q	journal	January 1990
The Theory of Atomic Structure and Spectra Cowan, Robert D. Los Alamos Series in Basic and Applied Sciences, Vol. 3 https://doi.org/10.1525/9780520906150	book	December 1981
Multiplet effects in X-ray spectroscopy Groot, Frank de Coordination Chemistry Reviews, Vol. 249, Issue 1-2 https://doi.org/10.1016/j.ccr.2004.03.018	journal	January 2005
Core Level Spectroscopy of Solids de Groot, Frank; Kotani, Akio CRC Press https://doi.org/10.1201/9781420008425	book	January 2008
Electronic structure of nanoporous ceria from x-ray absorption spectroscopy and atomic multiplet calculations Kucheyev, S. O.; Clapsaddle, B. J.; Wang, Y. M. Physical Review B, Vol. 76, Issue 23 https://doi.org/10.1103/PhysRevB.76.235420	journal	December 2007
The CTM4XAS program for EELS and XAS spectral shape analysis of transition metal L edges Stavitski, Eli; de Groot, Frank M. F. Micron, Vol. 41, Issue 7 https://doi.org/10.1016/j.micron.2010.06.005	journal	October 2010
High resolution mapping of surface reduction in ceria nanoparticles Turner, Stuart; Lazar, Sorin; Freitag, Bert Nanoscale, Vol. 3, Issue 8 https://doi.org/10.1039/c1nr10510h	journal	January 2011
Optical Absorption in Thin Films of Cerium Dioxide and Cerium Dioxide Containing Silicon Monoxide Hogarth, C. A.; Al-Dhhan, Z. T. physica status solidi (b), Vol. 137, Issue 2 https://doi.org/10.1002/pssb.2221370245	journal	October 1986
Charge-transfer spectra of tetravalent lanthanide ions in oxides Hoefdraad, H. E. Journal of Inorganic and Nuclear Chemistry, Vol. 37, Issue 9 https://doi.org/10.1016/0022-1902(75)80915-8	journal	September 1975
X-ray absorption at the oxygen K edge in cubic f oxides examined using a full multiple-scattering approach Wu, Z. Y.; Jollet, F.; Gota, S. Journal of Physics: Condensed Matter, Vol. 11, Issue 37 https://doi.org/10.1088/0953-8984/11/37/314	journal	September 1999
Determination of Ce4+/Ce3+ in electron-beam-damaged CeO2 by electron energy-loss spectroscopy Garvie, L. A. J.; Buseck, P. R. Journal of Physics and Chemistry of Solids, Vol. 60, Issue 12 https://doi.org/10.1016/S0022-3697(99)00218-8	journal	December 1999
Carbon K-Edge X-ray Absorption Spectroscopy and Time-Dependent Density Functional Theory Examination of Metal–Carbon Bonding in Metallocene Dichlorides Minasian, Stefan G.; Keith, Jason M.; Batista, Enrique R. Journal of the American Chemical Society, Vol. 135, Issue 39 https://doi.org/10.1021/ja405844j	journal	September 2013
Accurate treatment of solids with the HSE screened hybrid Henderson, Thomas M.; Paier, Joachim; Scuseria, Gustavo E. physica status solidi (b), Vol. 248, Issue 4 https://doi.org/10.1002/pssb.201046303	journal	October 2010
Density Functional Theory Studies of the Electronic Structure of Solid State Actinide Oxides Wen, Xiao-Dong; Martin, Richard L.; Henderson, Thomas M. Chemical Reviews, Vol. 113, Issue 2 https://doi.org/10.1021/cr300374y	journal	October 2012
Electronic structure and O K-edge XAS spectroscopy of U3O8 Wen, Xiao-Dong; Löble, Matthias W.; Batista, Enrique R. Journal of Electron Spectroscopy and Related Phenomena, Vol. 194 https://doi.org/10.1016/j.elspec.2014.03.005	journal	June 2014
Electronic structure of ${RuO}_{2}$ , ${OsO}_{2}$ , and ${IrO}_{2}$ Mattheiss, L. F. Physical Review B, Vol. 13, Issue 6 https://doi.org/10.1103/PhysRevB.13.2433	journal	March 1976
Energies of the Electronic Configurations of the Singly, Doubly, and Triply Ionized Lanthanides and Actinides Brewer, Leo Journal of the Optical Society of America, Vol. 61, Issue 12 https://doi.org/10.1364/JOSA.61.001666	journal	January 1971
Thermochemical properties of yttrium, lanthanum, and the lanthanide elements and ions Morss, Lester R. Chemical Reviews, Vol. 76, Issue 6 https://doi.org/10.1021/cr60304a007	journal	December 1976
Theoretical Investigation of Some Magnetic and Spectroscopic Properties of Rare-Earth Ions Freeman, A. J.; Watson, R. E. Physical Review, Vol. 127, Issue 6 https://doi.org/10.1103/PhysRev.127.2058	journal	September 1962
A Screened Hybrid DFT Study of Actinide Oxides, Nitrides, and Carbides Wen, Xiao-Dong; Martin, Richard L.; Scuseria, Gustavo E. The Journal of Physical Chemistry C, Vol. 117, Issue 25 https://doi.org/10.1021/jp403141t	journal	June 2013
Covalency in the actinide dioxides: Systematic study of the electronic properties using screened hybrid density functional theory Prodan, Ionut D.; Scuseria, Gustavo E.; Martin, Richard L. Physical Review B, Vol. 76, Issue 3 https://doi.org/10.1103/PhysRevB.76.033101	journal	July 2007
Segmented contraction scheme for small-core actinide pseudopotential basis sets Cao, Xiaoyan; Dolg, Michael Journal of Molecular Structure: THEOCHEM, Vol. 673, Issue 1-3 https://doi.org/10.1016/j.theochem.2003.12.015	journal	March 2004
Theoretical prediction of the second to fourth actinide ionization potentials Cao, Xiaoyan; Dolg, Michael Molecular Physics, Vol. 101, Issue 7 https://doi.org/10.1080/0026897021000046807	journal	April 2003
Ligand K-Edge X-ray Absorption Spectroscopy as a Probe of Ligand-Metal Bonding: Charge Donation and Covalency in Copper-Chloride Systems Shadle, Susan E.; Hedman, Britt; Hodgson, Keith O. Inorganic Chemistry, Vol. 33, Issue 19 https://doi.org/10.1021/ic00097a009	journal	September 1994
High Precision K-Shell Photoabsorption Cross Sections for Atomic Oxygen: Experiment and Theory McLaughlin, B. M.; Ballance, C. P.; Bowen, K. P. The Astrophysical Journal, Vol. 771, Issue 1 https://doi.org/10.1088/2041-8205/771/1/L8	journal	June 2013
Ln-4f/ligand-2p covalence in BaLnO3 and Cs3LnF7 (Ln=Ce, Pr, Tb) Hu, Z.; Kaindl, G.; Ogasawara, H. Chemical Physics Letters, Vol. 325, Issue 1-3 https://doi.org/10.1016/S0009-2614(00)00656-4	journal	July 2000
Hydrolytische spaltung von höheren oxiden des Praseodyms und des terbiums Brauer, G.; Pfeiffer, B. Journal of the Less Common Metals, Vol. 5, Issue 2 https://doi.org/10.1016/0022-5088(63)90010-9	journal	April 1963
Uranium oxides investigated by X-ray absorption and emission spectroscopies Magnuson, M.; Butorin, S. M.; Werme, L. Applied Surface Science, Vol. 252, Issue 15 https://doi.org/10.1016/j.apsusc.2005.12.131	journal	May 2006
Soft X-ray microscopy and spectroscopy at the molecular environmental science beamline at the Advanced Light Source Bluhm, H.; Andersson, K.; Araki, T. Journal of Electron Spectroscopy and Related Phenomena, Vol. 150, Issue 2-3 https://doi.org/10.1016/j.elspec.2005.07.005	journal	February 2006
Optimization of analysis of soft X-ray spectromicroscopy at the Ca 2p edge Hanhan, S.; Smith, A. M.; Obst, M. Journal of Electron Spectroscopy and Related Phenomena, Vol. 173, Issue 1 https://doi.org/10.1016/j.elspec.2009.04.010	journal	June 2009
A method for normalization of X-ray absorption spectra Weng, Tsu-Chien; Waldo, Geoffrey S.; Penner-Hahn, James E. Journal of Synchrotron Radiation, Vol. 12, Issue 4 https://doi.org/10.1107/S0909049504034193	journal	June 2005
Crystal-structure effects in the Ce $L_{3}$ -edge x-ray-absorption spectrum of ${CeO}_{2}$ : Multiple-scattering resonances and many-body final states Soldatov, A. V.; Ivanchenko, T. S.; Della Longa, S. Physical Review B, Vol. 50, Issue 8 https://doi.org/10.1103/PhysRevB.50.5074	journal	August 1994
Hybrid functionals based on a screened Coulomb potential Heyd, Jochen; Scuseria, Gustavo E.; Ernzerhof, Matthias The Journal of Chemical Physics, Vol. 118, Issue 18 https://doi.org/10.1063/1.1564060	journal	May 2003
Erratum: “Hybrid functionals based on a screened Coulomb potential” [J. Chem. Phys. 118, 8207 (2003)] Heyd, Jochen; Scuseria, Gustavo E.; Ernzerhof, Matthias The Journal of Chemical Physics, Vol. 124, Issue 21 https://doi.org/10.1063/1.2204597	journal	June 2006
Energy band gaps and lattice parameters evaluated with the Heyd-Scuseria-Ernzerhof screened hybrid functional Heyd, Jochen; Peralta, Juan E.; Scuseria, Gustavo E. The Journal of Chemical Physics, Vol. 123, Issue 17 https://doi.org/10.1063/1.2085170	journal	November 2005
Effect of spin-orbit coupling on the actinide dioxides AnO ₂ (An=Th, Pa, U, Np, Pu, and Am): A screened hybrid density functional study Wen, Xiao-Dong; Martin, Richard L.; Roy, Lindsay E. The Journal of Chemical Physics, Vol. 137, Issue 15 https://doi.org/10.1063/1.4757615	journal	October 2012
Screened hybrid and DFT + U studies of the structural, electronic, and optical properties of U ₃ O ₈ Wen, Xiao-Dong; Martin, Richard L.; Scuseria, Gustavo E. Journal of Physics: Condensed Matter, Vol. 25, Issue 2 https://doi.org/10.1088/0953-8984/25/2/025501	journal	November 2012
Projector augmented-wave method Blöchl, P. E. Physical Review B, Vol. 50, Issue 24, p. 17953-17979 https://doi.org/10.1103/PhysRevB.50.17953	journal	December 1994
From ultrasoft pseudopotentials to the projector augmented-wave method Kresse, G.; Joubert, D. Physical Review B, Vol. 59, Issue 3, p. 1758-1775 https://doi.org/10.1103/PhysRevB.59.1758	journal	January 1999

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