The structural and chemical origin of the oxygen redox activity in layered and cation-disordered Li-excess cathode materials DH Seo, J Lee, A Urban, R Malik, SY Kang, G Ceder Nature chemistry 8 (7), 692-697, 2016 | 1260 | 2016 |
Unlocking the Potential of Cation-Disordered Oxides for Rechargeable Lithium Batteries J Lee, A Urban, X Li, D Su, G Hautier, G Ceder Science 343 (6170), 519-522, 2014 | 1129 | 2014 |
An implementation of artificial neural-network potentials for atomistic materials simulations: Performance for TiO 2 N Artrith, A Urban Computational Materials Science 114, 135-150, 2016 | 535 | 2016 |
Computational understanding of Li-ion batteries A Urban, DH Seo, G Ceder npj Computational Materials 2, 16002, 2016 | 473 | 2016 |
The Configurational Space of Rocksalt‐Type Oxides for High‐Capacity Lithium Battery Electrodes A Urban, J Lee, G Ceder Advanced Energy Materials 4 (13), 1400478, 2014 | 333 | 2014 |
Efficient and accurate machine-learning interpolation of atomic energies in compositions with many species N Artrith, A Urban, G Ceder Physical Review B 96 (1), 014112, 2017 | 331 | 2017 |
Hidden structural and chemical order controls lithium transport in cation-disordered oxides for rechargeable batteries H Ji, A Urban, DA Kitchaev, DH Kwon, N Artrith, C Ophus, W Huang, Z Cai, ... Nature Communications 10 (1), 592, 2019 | 210 | 2019 |
Ultrahigh power and energy density in partially ordered lithium-ion cathode materials H Ji, J Wu, Z Cai, J Liu, DH Kwon, H Kim, A Urban, JK Papp, E Foley, ... Nature Energy 5 (3), 213-221, 2020 | 197 | 2020 |
A disordered rock-salt Li-excess cathode material with high capacity and substantial oxygen redox activity: Li 1.25 Nb 0.25 Mn 0.5 O 2. R Wang, X Li, L Liu, J Lee, DH Seo, SH Bo, A Urban, G Ceder Electrochemistry Communications 60, 70-73, 2015 | 186 | 2015 |
Constructing first-principles phase diagrams of amorphous LixSi using machine-learning-assisted sampling with an evolutionary algorithm N Artrith, A Urban, G Ceder The Journal of Chemical Physics 148 (24), 241711, 2018 | 166 | 2018 |
Calibrating transition-metal energy levels and oxygen bands in first-principles calculations: Accurate prediction of redox potentials and charge transfer in lithium transition … DH Seo, A Urban, G Ceder Physical Review B 92 (11), 115118, 2015 | 163 | 2015 |
Electronic-Structure Origin of Cation Disorder in Transition-Metal Oxides A Urban, A Abdellahi, S Dacek, N Artrith, G Ceder Physical Review Letters 119 (17), 176402, 2017 | 158 | 2017 |
The intercalation phase diagram of Mg in V2O5 from first principles G Sai Gautam, P Canepa, A Abdellahi, A Urban, R Malik, G Ceder Chemistry of Materials 27, 3733–3742, 2015 | 156 | 2015 |
Stoichiometric Layered Potassium Transition Metal Oxide for Rechargeable Potassium Batteries H Kim, DH Seo, A Urban, J Lee, DH Kwon, SH Bo, T Shi, JK Papp, ... Chemistry of Materials 30 (18), 6532-6539, 2018 | 134 | 2018 |
First-Principles Simulation of the (Li–Ni–Vacancy) O Phase Diagram and Its Relevance for the Surface Phases in Ni-Rich Li-Ion Cathode Materials H Das, A Urban, W Huang, G Ceder Chemistry of Materials 29 (18), 7840-7851, 2017 | 112 | 2017 |
Computational Design and Preparation of Cation‐Disordered Oxides for High‐Energy‐Density Li‐Ion Batteries A Urban, I Matts, A Abdellahi, G Ceder Advanced Energy Materials 6 (15), 1600488, 2016 | 111 | 2016 |
Effect of Fluorination on Lithium Transport and Short‐Range Order in Disordered‐Rocksalt‐Type Lithium‐Ion Battery Cathodes B Ouyang†, N Artrith†, Z Lun†, Z Jadidi, DA Kitchaev, H Ji, A Urban, ... Advanced Energy Materials, 1903240, 2020 | 101 | 2020 |
Understanding the Effect of Cation Disorder on the Voltage Profile of Lithium Transition-Metal Oxides A Abdellahi, A Urban, S Dacek, G Ceder Chemistry of Materials 28 (15), 5373-5383, 2016 | 101 | 2016 |
Influence of inversion on Mg mobility and electrochemistry in spinels G Sai Gautam, P Canepa, A Urban, SH Bo, G Ceder Chemistry of Materials 29 (18), 7918-7930, 2017 | 87 | 2017 |
The Effect of Cation Disorder on the Average Li Intercalation Voltage of Transition-Metal Oxides A Abdellahi, A Urban, S Dacek, G Ceder Chemistry of Materials 28 (11), 3659-3665, 2016 | 78 | 2016 |