Publications
Found 17 results
Filters: Author is Morgan, Dane [Clear All Filters]
“Kinetics of Oxygen Surface Exchange on Epitaxial Ruddlesden-Popper Phases and Correlations to First-Principles Descriptors”, Journal of Physical Chemistry Letters, vol. 7, no. 2, pp. 244 - 249, 2016.
, “Ab initio GGA plus U study of oxygen evolution and oxygen reduction electrocatalysis on the (001) surfaces of lanthanum transition metal perovskites LaBO3 (B = Cr, Mn, Fe, Co and Ni)”, Physical Chemistry Chemical Physics, vol. 17, no. 33, pp. 21643 - 21663, 2015.
, “Oxygen surface exchange kinetics and stability of (La,Sr)(2)CoO4 +/-delta/La1-xSrxMO3-delta (M = Co and Fe) hetero-interfaces at intermediate temperatures”, Journal of Materials Chemistry A, vol. 3, no. 5, pp. 2144 - 2157, 2015.
, “Anomalous Interface and Surface Strontium Segregation in (La1-ySry)(2)CoO4 +/-delta/La1-xSrxCoO3-delta Heterostructured Thin Films”, Journal of Physical Chemistry Letters, vol. 5, no. 6, pp. 1027 - 1034, 2014.
, “Enhanced Oxygen Surface Exchange Kinetics and Stability on Epitaxial La0.8Sr0.2CoO3-delta Thin Films by La0.8Sr0.2MnO3-delta Decoration”, Journal of Physical Chemistry C, vol. 118, no. 26, pp. 14326 - 14334, 2014.
, “Strontium influence on the oxygen electrocatalysis of La2-xSrxNiO4 +/-delta (0.0 <= x(Sr) <= 1.0) thin films”, Journal of Materials Chemistry A, vol. 2, no. 18, pp. 6480 - 6487, 2014.
, “Spatially Resolved Mapping of Oxygen Reduction/Evolution Reaction on Solid-Oxide Fuel Cell Cathodes with Sub-10 nm Resolution”, Acs Nano, vol. 7, no. 5, pp. 3808 - 3814, 2013.
, “Tuning the Spin State in LaCoO3 Thin Films for Enhanced High-Temperature Oxygen Electrocatalysis”, Journal of Physical Chemistry Letters, vol. 4, no. 15, pp. 2493 - 2499, 2013.
, “Surface strontium enrichment on highly active perovskites for oxygen electrocatalysis in solid oxide fuel cells”, Energy & Environmental Science, vol. 5, no. 3, pp. 6081 - 6088, 2012.
, “Prediction of solid oxide fuel cell cathode activity with first-principles descriptors”, Energy & Environmental Science, vol. 4, no. 10, pp. 3966 - 3970, 2011.
, “First principles study of Li diffusion in I-Li2NiO2 structure”, Physical Review B, vol. 79, no. 1, 2009.
, “Pt nanoparticle stability in PEM fuel cells: influence of particle size distribution and crossover hydrogen”, Energy & Environmental Science, vol. 2, no. 8, pp. 865 - 871, 2009.
, “A practical approach to the prediction of crystal structure by merging data-mining methods with first principles quantum mechanics”, Abstracts of Papers of the American Chemical Society, vol. 233, 2007.
, “Ultra-fast evaluation of protein energies directly from sequence: Speeding up protein design”, Biophysical Journal, p. 218A - 218A, 2007.
, “Ab initio study of the composition dependence of the pressure-induced spin transition in the (Mg1-x,Fe-x)O system”, Geophysical Research Letters, vol. 33, no. 16, 2006.
, “Predicting crystal structure by merging data mining with quantum mechanics”, Nature Materials, vol. 5, no. 8, pp. 641 - 646, 2006.
, “Ultra-fast evaluation of protein energies directly from sequence”, Plos Computational Biology, vol. 2, no. 6, pp. 551 - 563, 2006.
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