Alexander Urban
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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
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
Computational understanding of Li-ion batteries
A Urban, DH Seo, G Ceder
npj Computational Materials 2, 16002, 2016
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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