D. E. Ellis

Northwestern University — United States

Physics and Astronomy · Physical Sciences

60h-index18.0kcitations434works0.02yr avg
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Research Topics

Advanced Chemical Physics Studies(115), Rare-earth and actinide compounds(41), Crystal Structures and Properties(37), Electronic and Structural Properties of Oxides(36), Advanced Condensed Matter Physics(34)

Publications433 total

Hydroxyapatite and lead-substituted hydroxyapatite near-surface structures: Novel modelling of photoemission lines from X-ray photoelectron spectra
Applied Surface Science·2021· 71 cited
Low Lying Magnetic States of the Mixed Valence Cobalt Ludwigite
physica status solidi (b)·2019· 5 cited
Low lying magnetic states of the mixed valence cobalt ludwigite
arXiv (Cornell University)·2018Open Access
First principles calculations on the magnetic state of the mixed valence cobalt ludwigite
arXiv (Cornell University)·2018Open Access
Structure Sensitivity of Acrolein Hydrogenation by Platinum Nanoparticles on Ba<sub><i>x</i></sub>Sr<sub>1−<i>x</i></sub>TiO<sub>3</sub> Nanocuboids
ChemCatChem·2017· 9 citedOpen Access
Site Identity and Importance in Cosubstituted Bixbyite In2O3
Crystals·2017· 4 citedOpen Access
Cation synergies affect ammonia adsorption over VOX and (V,W)OX dispersed on α-Al2O3 (0001) and α-Fe2O3 (0001)
Surface Science·2016· 8 citedOpen Access
Site Dependency of the High Conductivity of Ga<sub>2</sub>In<sub>6</sub>Sn<sub>2</sub>O<sub>16</sub>: The Role of the 7-Coordinate Site
Chemistry of Materials·2015· 7 citedOpen Access
Atomic-Scale View of VO<sub>X</sub>–WO<sub>X</sub>Coreduction on the α-Al<sub>2</sub>O<sub>3</sub>(0001) Surface
The Journal of Physical Chemistry C·2015· 9 cited
RASPA: molecular simulation software for adsorption and diffusion in flexible nanoporous materials
Molecular Simulation·2015· 1.9k citedOpen Access
Interface of Pt with SrTiO3(001); A combined theoretical and experimental study
Surface Science·2014· 10 citedOpen Access
First principles calculation of magnetic order in a low-temperature phase of the iron ludwigite
Journal of Magnetism and Magnetic Materials·2014· 14 cited
Structure and reactivity of zero-, two- and three-dimensional Pd supported on SrTiO3(001)
Surface Science·2014· 5 cited
Adaptive cluster expansions and redox-dependent atomic ordering
Computational Materials Science·2013· 2 cited
ChemInform Abstract: Syntheses and Characterization of Six Quaternary Uranium Chalcogenides A<sub>2</sub>M<sub>4</sub>U<sub>6</sub>Q<sub>17</sub> (A: Rb or Cs; M: Pd or Pt; Q: S or Se).
ChemInform·2012
ChemInform Abstract: Single‐Crystal Structures, Optical Absorptions, and Electronic Distributions of Thorium Oxychalcogenides ThOQ (Q: S, Se, Te).
ChemInform·2012
Syntheses and Characterization of Six Quaternary Uranium Chalcogenides A<sub>2</sub>M<sub>4</sub>U<sub>6</sub>Q<sub>17</sub> (A = Rb or Cs; M = Pd or Pt; Q = S or Se)
Inorganic Chemistry·2012· 16 cited
Single-Crystal Structures, Optical Absorptions, and Electronic Distributions of Thorium Oxychalcogenides ThOQ (Q = S, Se, Te)
Inorganic Chemistry·2012· 22 cited
Structure and properties of a model oxide-supported catalyst under redox conditions: WOx/α-Fe2O3 (0001)
Surface Science·2012· 6 cited
Oxidation State of Uranium in A<sub>6</sub>Cu<sub>12</sub>U<sub>2</sub>S<sub>15</sub>(A = K, Rb, Cs) Compounds
Inorganic Chemistry·2012· 30 cited
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Frequent Co-authors

Randall Q. Snurr(6), Oliver Warschkow(6), David Dubbeldam(5), Evert Jan Baerends(4), F. W. Averill(4), Joice Terra(4), Gabriela B. González(4), Alexandre Malta Rossi(4), Arne Rosén(3), Laurence D. Marks(3), Krista S. Walton(3), Thomas O. Mason(3), E. A. Kotomin(3), P. Ros(2), G. S. Painter(2), B. Delley(2), A. J. Freeman(2), Natasha Erdman(2), Kenneth R. Poeppelmeier(2), Mark Asta(2)