| Materials design and discovery with high-throughput density functional theory: the open quantum materials database (OQMD) JE Saal, S Kirklin, M Aykol, B Meredig, C Wolverton Jom 65, 1501-1509, 2013 | 2264 | 2013 |
| The Open Quantum Materials Database (OQMD): assessing the accuracy of DFT formation energies S Kirklin, JE Saal, B Meredig, A Thompson, JW Doak, M Aykol, S Rühl, ... npj Computational Materials 1 (1), 1-15, 2015 | 1742 | 2015 |
| Combinatorial screening for new materials in unconstrained composition space with machine learning B Meredig, A Agrawal, S Kirklin, JE Saal, JW Doak, A Thompson, K Zhang, ... Physical Review B 89 (9), 094104, 2014 | 766 | 2014 |
| High-throughput computational screening of perovskites for thermochemical water splitting applications AA Emery, JE Saal, S Kirklin, VI Hegde, C Wolverton Chemistry of Materials 28 (16), 5621-5634, 2016 | 272 | 2016 |
| High‐throughput computational screening of new Li‐ion battery anode materials S Kirklin, B Meredig, C Wolverton Advanced Energy Materials 3 (2), 252-262, 2013 | 231 | 2013 |
| Microporous polyphenylenes with tunable pore size for hydrogen storage S Yuan, B Dorney, D White, S Kirklin, P Zapol, L Yu, DJ Liu Chemical communications 46 (25), 4547-4549, 2010 | 231 | 2010 |
| Nanoporous polymers containing stereocontorted cores for hydrogen storage S Yuan, S Kirklin, B Dorney, DJ Liu, L Yu Macromolecules 42 (5), 1554-1559, 2009 | 216 | 2009 |
| High-throughput computational design of cathode coatings for Li-ion batteries M Aykol, S Kim, VI Hegde, D Snydacker, Z Lu, S Hao, S Kirklin, D Morgan, ... Nature communications 7 (1), 13779, 2016 | 193 | 2016 |
| Thermodynamic Aspects of Cathode Coatings for Lithium‐Ion Batteries M Aykol, S Kirklin, C Wolverton Advanced Energy Materials 4 (17), 1400690, 2014 | 136 | 2014 |
| High-throughput computational search for strengthening precipitates in alloys S Kirklin, JE Saal, VI Hegde, C Wolverton Acta Materialia 102, 125-135, 2016 | 108 | 2016 |
| Approaching chemical accuracy with density functional calculations: Diatomic energy corrections S Grindy, B Meredig, S Kirklin, JE Saal, C Wolverton Physical Review B—Condensed Matter and Materials Physics 87 (7), 075150, 2013 | 108 | 2013 |
| Nanoporous polyporphyrin as adsorbent for hydrogen storage J Xia, S Yuan, Z Wang, S Kirklin, B Dorney, DJ Liu, L Yu Macromolecules 43 (7), 3325-3330, 2010 | 106 | 2010 |
| Material design of high-capacity Li-rich layered-oxide electrodes: Li 2 MnO 3 and beyond S Kim, M Aykol, VI Hegde, Z Lu, S Kirklin, JR Croy, MM Thackeray, ... Energy & Environmental Science 10 (10), 2201-2211, 2017 | 102 | 2017 |
| High-throughput screening of high-capacity electrodes for hybrid Li-ion–Li–O 2 cells S Kirklin, MKY Chan, L Trahey, MM Thackeray, C Wolverton Physical Chemistry Chemical Physics 16 (40), 22073-22082, 2014 | 45 | 2014 |
| Vision for Designing High-Energy, Hybrid Li Ion/Li–O2 Cells MM Thackeray, MKY Chan, L Trahey, S Kirklin, C Wolverton The Journal of Physical Chemistry Letters 4 (21), 3607-3611, 2013 | 45 | 2013 |
| The phase stability network of all inorganic materials VI Hegde, M Aykol, S Kirklin, C Wolverton Science advances 6 (9), eaay5606, 2020 | 43 | 2020 |
| Stability and equation of state of post-aragonite BaCO3 JP Townsend, YY Chang, X Lou, M Merino, SJ Kirklin, JW Doak, A Issa, ... Physics and Chemistry of Minerals 40, 447-453, 2013 | 21 | 2013 |
| Lithium-ion cathode/coating pairs for transition metal containment DH Snydacker, M Aykol, S Kirklin, C Wolverton Journal of The Electrochemical Society 163 (9), A2054, 2016 | 18 | 2016 |
| Mixed polyanion glass cathodes: glass-state conversion reactions AK Kercher, JA Kolopus, KJ Carroll, RR Unocic, S Kirklin, C Wolverton, ... Journal of The Electrochemical Society 163 (2), A131, 2015 | 17 | 2015 |
| Computational evaluation of new lithium-3 garnets for lithium-ion battery applications as anodes, cathodes, and solid-state electrolytes M Aykol, S Kim, VI Hegde, S Kirklin, C Wolverton Physical Review Materials 3 (2), 025402, 2019 | 16 | 2019 |
Chris WolvertonProfessor of Materials Science and Eng., Northwestern UniversityVerified email at northwestern.edu