First-principles study of native point defects in ZnO AF Kohan, G Ceder, D Morgan, CG Van de Walle Physical Review B 61 (22), 15019, 2000 | 2254 | 2000 |
Li conductivity in li x mpo 4 (m= mn, fe, co, ni) olivine materials D Morgan, A Van der Ven, G Ceder Electrochemical and solid-state letters 7 (2), A30, 2003 | 1407 | 2003 |
AFLOW: An automatic framework for high-throughput materials discovery S Curtarolo, W Setyawan, GLW Hart, M Jahnatek, RV Chepulskii, ... Computational Materials Science 58, 218-226, 2012 | 1345 | 2012 |
First-principles prediction of redox potentials in transition-metal compounds with F Zhou, M Cococcioni, CA Marianetti, D Morgan, G Ceder Physical Review B—Condensed Matter and Materials Physics 70 (23), 235121, 2004 | 1202 | 2004 |
Instability of supported platinum nanoparticles in low-temperature fuel cells Y Shao-Horn, WC Sheng, S Chen, PJ Ferreira, EF Holby, D Morgan Topics in Catalysis 46, 285-305, 2007 | 1169 | 2007 |
Instability of Pt∕ C electrocatalysts in proton exchange membrane fuel cells: a mechanistic investigation PJ Ferreira, Y Shao-Horn, D Morgan, R Makharia, S Kocha, HA Gasteiger Journal of the Electrochemical Society 152 (11), A2256, 2005 | 1008 | 2005 |
Prediction of solid oxide fuel cell cathode activity with first-principles descriptors YL Lee, J Kleis, J Rossmeisl, Y Shao-Horn, D Morgan Energy & Environmental Science 4 (10), 3966-3970, 2011 | 594 | 2011 |
Predicting crystal structure by merging data mining with quantum mechanics CC Fischer, KJ Tibbetts, D Morgan, G Ceder Nature materials 5 (8), 641-646, 2006 | 566 | 2006 |
Ab initio energetics of (, Fe, Co, and Ni) for solid oxide fuel cell cathodes YL Lee, J Kleis, J Rossmeisl, D Morgan Physical Review B—Condensed Matter and Materials Physics 80 (22), 224101, 2009 | 538 | 2009 |
Predicting crystal structures with data mining of quantum calculations S Curtarolo, D Morgan, K Persson, J Rodgers, G Ceder Physical review letters 91 (13), 135503, 2003 | 515 | 2003 |
The electronic structure and band gap of LiFePO4 and LiMnPO4 F Zhou, K Kang, T Maxisch, G Ceder, D Morgan Solid State Communications 132 (3-4), 181-186, 2004 | 502 | 2004 |
Surface strontium enrichment on highly active perovskites for oxygen electrocatalysis in solid oxide fuel cells EJ Crumlin, E Mutoro, Z Liu, ME Grass, MD Biegalski, YL Lee, D Morgan, ... Energy & Environmental Science 5 (3), 6081-6088, 2012 | 413 | 2012 |
New frontiers for the materials genome initiative JJ de Pablo, NE Jackson, MA Webb, LQ Chen, JE Moore, D Morgan, ... npj Computational Materials 5 (1), 41, 2019 | 411 | 2019 |
Accuracy of ab initio methods in predicting the crystal structures of metals: A review of 80 binary alloys S Curtarolo, D Morgan, G Ceder Calphad 29 (3), 163-211, 2005 | 404 | 2005 |
Opportunities and challenges for machine learning in materials science D Morgan, R Jacobs Annual Review of Materials Research 50 (1), 71-103, 2020 | 384 | 2020 |
Pt nanoparticle stability in PEM fuel cells: influence of particle size distribution and crossover hydrogen EF Holby, W Sheng, Y Shao-Horn, D Morgan Energy & Environmental Science 2 (8), 865-871, 2009 | 350 | 2009 |
Nondilute diffusion from first principles: Li diffusion in A Van der Ven, JC Thomas, Q Xu, B Swoboda, D Morgan Physical Review B—Condensed Matter and Materials Physics 78 (10), 104306, 2008 | 308 | 2008 |
Electrochemical modeling of intercalation processes with phase field models BC Han, A Van der Ven, D Morgan, G Ceder Electrochimica Acta 49 (26), 4691-4699, 2004 | 296 | 2004 |
First-principles study of the stability and electronic structure of metal hydrides H Smithson, CA Marianetti, D Morgan, A Van der Ven, A Predith, G Ceder Physical Review B 66 (14), 144107, 2002 | 268 | 2002 |
Origins of large voltage hysteresis in high-energy-density metal fluoride lithium-ion battery conversion electrodes L Li, R Jacobs, P Gao, L Gan, F Wang, D Morgan, S Jin Journal of the American Chemical Society 138 (8), 2838-2848, 2016 | 265 | 2016 |