Daniil A. Kitchaev
Daniil A. Kitchaev
Research Engineer, Bosch Research and Technology Center
Verified email at - Homepage
Cited by
Cited by
Reversible Mn 2+/Mn 4+ double redox in lithium-excess cathode materials
J Lee, DA Kitchaev, DH Kwon, CW Lee, JK Papp, YS Liu, Z Lun, ...
Nature 556 (7700), 185-190, 2018
Energetics of MnO 2 polymorphs in density functional theory
DA Kitchaev, H Peng, Y Liu, J Sun, JP Perdew, G Ceder
Physical Review B 93 (4), 045132, 2016
Electrochemical trapping of metastable Mn3+ ions for activation of MnO2 oxygen evolution catalysts
Z Morgan Chan, DA Kitchaev, J Nelson Weker, C Schnedermann, K Lim, ...
Proceedings of the National Academy of Sciences 115 (23), E5261-E5268, 2018
Efficient first-principles prediction of solid stability: Towards chemical accuracy
Y Zhang, DA Kitchaev, J Yang, T Chen, ST Dacek, RA Sarmiento-Pérez, ...
Npj Computational Materials 4 (1), 1-6, 2018
Thermodynamics of Phase Selection in MnO2 Framework Structures through Alkali Intercalation and Hydration
DA Kitchaev, ST Dacek, W Sun, G Ceder
Journal of the American Chemical Society 139 (7), 2672-2681, 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), 1-9, 2019
Design principles for high transition metal capacity in disordered rocksalt Li-ion cathodes
DA Kitchaev, Z Lun, WD Richards, H Ji, RJ Clément, M Balasubramanian, ...
Energy & Environmental Science 11 (8), 2159-2171, 2018
Fluorination of Lithium‐Excess Transition Metal Oxide Cathode Materials
WD Richards, ST Dacek, DA Kitchaev, G Ceder
Advanced Energy Materials 8 (5), 1701533, 2018
Understanding crystallization pathways leading to manganese oxide polymorph formation
BR Chen, W Sun, DA Kitchaev, JS Mangum, V Thampy, LM Garten, ...
Nature communications 9 (1), 1-9, 2018
Improved Cycling Performance of Li‐Excess Cation‐Disordered Cathode Materials upon Fluorine Substitution
Z Lun, B Ouyang, DA Kitchaev, RJ Clément, JK Papp, ...
Advanced Energy Materials 9 (2), 1802959, 2019
The interplay between thermodynamics and kinetics in the solid-state synthesis of layered oxides
M Bianchini, J Wang, RJ Clément, B Ouyang, P Xiao, D Kitchaev, T Shi, ...
Nature Materials 19 (10), 1088-1095, 2020
High-fraction brookite films from amorphous precursors
JES Haggerty, LT Schelhas, DA Kitchaev, JS Mangum, LM Garten, W Sun, ...
Scientific reports 7 (1), 1-11, 2017
Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite
DA Kitchaev, G Ceder
Nature Communications 7, 13799, 2016
Design Principles for High-Capacity Mn-Based Cation-Disordered Rocksalt Cathodes
Z Lun, B Ouyang, Z Cai, RJ Clément, DH Kwon, J Huang, JK Papp, ...
Chem 6 (1), 153-168, 2020
Non-equilibrium crystallization pathways of manganese oxides in aqueous solution
W Sun, DA Kitchaev, D Kramer, G Ceder
Nature communications 10 (1), 1-9, 2019
Short-range order and unusual modes of nickel redox in a fluorine-substituted disordered rocksalt oxide lithium-ion cathode
RJ Clément, D Kitchaev, J Lee, G Ceder
Chemistry of Materials 30 (19), 6945-6956, 2018
Structure and Dynamics of Fluorophosphate Na-Ion Battery Cathodes
ST Dacek, WD Richards, DA Kitchaev, G Ceder
Chemistry of Materials 28 (15), 5450-5460, 2016
Rationalizing accurate structure prediction in the meta-GGA SCAN functional
JH Yang, DA Kitchaev, G Ceder
Physical Review B 100 (3), 035132, 2019
An efficient algorithm for finding the minimum energy path for cation migration in ionic materials
Z Rong, D Kitchaev, P Canepa, W Huang, G Ceder
The Journal of Chemical Physics 145 (7), 074112, 2016
Rapid Photovoltaic Device Characterization through Bayesian Parameter Estimation
RE Brandt, RC Kurchin, V Steinmann, D Kitchaev, C Roat, S Levcenco, ...
Joule 1 (4), 843-856, 2017
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