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Andreas E. Bumberger, Sergej Ražnjević, Zaoli Zhang, Gernot Friedbacher and Juergen Fleig

J. Mater. Chem. A, 2023, 11, 24072
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Tracking phase transformations in LiMn1.5+xNi0.5−xO4 by high resolution X-ray diffraction

Halvor Høen Hval and Helmer Fjellvåg

J. Mater. Chem. A, 2025, 13, 41122
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Kinetically controlled synthesis of low-strain disordered micro–nano high voltage spinel cathodes with exposed {111} facets

Zhi-Qi Li, Yi-Feng Liu, Han-Xiao Liu, Yan-Fang Zhu, Jingqiang Wang, Mengke Zhang, Lang Qiu, Xiao-Dong Guo, Shu-Lei Chou and Yao Xiao

Chem. Sci., 2024, 15, 11302
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Heat generation behavior of high-voltage spinel LiNi0.5Mn1.5O4 cathodes under varying cycling conditions and material configurations

Kevin Böhm, Aleksandr Kondrakov, Torsten Markus and David Henriques

EES Batteries, 2026
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Precursor chemistry governing morphology and cation disorder in AgBiS2 solar absorber for photoelectrochemical water splitting

Dayeon Lee, Neul Ha, Jaemin Park, Jisu Jung, Jaewook Lee, Ji Hoon Kim, Sang Uck Lee, Dong-Won Kang, Kaiying Wang and Wooseok Yang

J. Mater. Chem. A, 2026
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Imperfections are not 0 K: free energy of point defects in crystals

Irea Mosquera-Lois, Seán R. Kavanagh, Johan Klarbring, Kasper Tolborg and Aron Walsh

Chem. Soc. Rev., 2023, 52, 5812
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Investigation of Capacity Fading Mechanism on Nanocrystalline LiNi0.5Mn0.5O2 Synthesized by Autocombustion Technique

Vikash Mahato, Sudip Kumar, Arindam Sen, Syed Md Burhan Ali, Chandan Ghanty and Rajen Kundu

Chemistry Africa, 2024, 7, 1675
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A comprehensive overview of lithium-ion batteries for electric vehicles: Materials, performance, safety, recycling, and emerging technologies

Francesco Sciatti, Paolo Tamburrano, Elia Distaso, Riccardo Amirante, Antonio V. Radogna, Arianna Morciano and Giuseppe Grassi

Journal of Energy Storage, 2026, 144, 119694
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Entropy-stabilized spinel oxide cathode with cationic disorder for high-performance intermediate-temperature solid oxide fuel cells

Tianxi Qiu, Liping Sun, Yiqian Li, Qiang Li, Lihua Huo and Hui Zhao

Surfaces and Interfaces, 2025, 72, 107028
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Identification of degree of ordering in spinel LiNi0.5Mn1.5O4 through NMR and Raman spectroscopies supported by theoretical calculations

Gozde Oney, Jon Serrano Sevillano, Mouna Ben Yahia, Jacob Olchowka, Emmanuelle Suard, Francois Weill, Arnaud Demortière, Montse Casas Cabanas, Laurence Croguennec and Dany Carlier

Energy Storage Materials, 2024, 70, 103486
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Optimizing the Efficiency of Lead‐Free Cs2TiI6‐Based Double Halide Perovskite Solar Cells Using SCAPS‐1D

Ubaid ur Rehman, Nouf Almousa, Kashaf ul Sahar, Arslan Ashfaq, Khalid Mahmood, Elsammani Ali Shokralla, Mohammed S. Al-Buriahi, Ziyad A. Alrowaili, Rey Y. Capangpangan and Arnold C. Alguno

Energy Tech, 2023, 11
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Computational Prediction of an Antimony-Based n-Type Transparent Conducting Oxide: F-Doped Sb2O5

Ke Li, Joe Willis, Seán R. Kavanagh and David O. Scanlon

Chem. Mater., 2024, 36, 2907
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Oxygen Dimerization as a Defect-Driven Process in Bulk LiNiO2

Alexander G. Squires, Lavan Ganeshkumar, Christopher N. Savory, Seán R. Kavanagh and David O. Scanlon

ACS Energy Lett., 2024, 9, 4180
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Machine-learning structural reconstructions for accelerated point defect calculations

Irea Mosquera-Lois, Seán R. Kavanagh, Alex M. Ganose and Aron Walsh

npj Comput Mater, 2024, 10
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Beyond the Known: Emerging Insights into Cation Disorder in Multinary Compounds

Jisu Jung, Neul Ha and Wooseok Yang

ACS Appl. Mater. Interfaces, 2025, 17, 16410
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doped: Python toolkit for robust and repeatable charged defect supercell calculations

Seán R. Kavanagh, Alexander G. Squires, Adair Nicolson, Irea Mosquera-Lois, Alex M. Ganose, Bonan Zhu, Katarina Brlec, Aron Walsh and David O. Scanlon

JOSS, 2024, 9, 6433
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Identifying split vacancy defects with machine-learned foundation models and electrostatics

Seán R Kavanagh

J. Phys. Energy, 2025, 7, 045002
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Defect Chemistry in High‐Voltage Cathode Materials for Lithium‐Ion Batteries

Yu Mei, Junxiang Liu, Tony Cui, Yujin Li, Tongchao Liu, Xiaobo Ji and Khalil Amine

Advanced Materials, 2025, 37
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Defect Tolerance via External Passivation in the Photocatalyst SrTiO3:Al

Kanta Ogawa, Seán R Kavanagh, Fumiyasu Oba and Aron Walsh

J. Am. Chem. Soc., 2025, 147, 23180
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Unveiling the Hidden Influence of Defects via Experiment and Data Science

Justin Sambur and Jakoah Brgoch

Chem. Mater., 2023, 35, 7351
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Improving electrochemical performances of LiNi0.5Mn1.5O4 by the strategy of oxygen vacancy doping

Hao Ding, Peng Wang, Ningshuang Zhang, Junfei Zhou, Xin Li, Chengyu Li, Dongni Zhao and Shiyou Li

Applied Materials Today, 2024, 38, 102248
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Unlocking 5 V-Class Lithium-Ion Batteries: Challenges and Perspectives on High-Voltage LNMO Cathodes

Taemin Kim, Hyunsoo Oh, Seongmin Yang and Hyeon Jeong Lee

ACS Appl. Energy Mater., 2025, 8, 13155
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Defects go green: using defects in nanomaterials for renewable energy and environmental sustainability

Addis S. Fuhr, Bobby G. Sumpter and Panchapakesan Ganesh

Front. Nanotechnol., 2023, 5
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Tuning the magnetic and electronic properties of LiNi0.5Mn1.5O4 with post-sintering treatments via oxygen non-stoichiometry

Rishabh Shukla, Jon G. Bell, Shangxiong Huangfu, Luca Artiglia and Michael Stuer

Journal of Alloys and Compounds, 2025, 1015, 178873
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Recent Progress of High Voltage Spinel LiMn1.5Ni0.5O4 Cathode Material for Lithium-Ion Battery: Surface Modification, Doping, Electrolyte, and Oxygen Deficiency

Seokyoung Choi, Wuliang Feng and Yongyao Xia

ACS Omega, 2024, 9, 18688
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Progress on the Attenuation Mechanism and Modification of the Cobalt‐Free Spinel LiNi0.5Mn1.5O4

Bao Zhang, Zhen Liang, Peng Dong, Weili Song, Yiyong Zhang, Xue Li, Xiaoyuan Zeng, Yongkang Liu, Ziliang Feng, Enfeng Zhang, Yingjie Zhang and Yannan Zhang

Advanced Science, 2025, 12
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Li‐Site Defects Induce Formation of Li‐Rich Impurity Phases: Implications for Charge Distribution and Performance of LiNi0.5−xMxMn1.5O4 Cathodes (M = Fe and Mg; x = 0.05–0.2)

Beth E. Murdock, Jiayi Cen, Alexander G. Squires, Seán R. Kavanagh, David O. Scanlon, Li Zhang and Nuria Tapia‐Ruiz

Advanced Materials, 2024, 36
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Stabilizing the Mn4+/Mn3+ redox at 2.7 V plateau in LiNi0.5Mn1.5O4 cathode material for high energy density and long cycle lifetime via Mo6+ doping

Zhen Zhang, Chengkang Chang and Jiening Zheng

Journal of Energy Storage, 2024, 99, 113226
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Te doping stabilizes the P4332 structure and enhances the electrochemical performance of LiNi0.5Mn1.5O4 over 2.0–5.0 V

Yanan Zhang, Hanlin Li, Zhen Zhang and Chengkang Chang

J Solid State Electrochem, 2026
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Boosting interface compatibility of high-voltage LiNi0.5Mn1.5O4 cathode materials with an ionic-conductive Li0.33La0.56TiO3 coating

Jianming Tao, Zerui Yan, Yanmin Yang and Yingbin Lin

Applied Surface Science, 2024, 668, 160448
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