A novel P3-type Na2/3Mg1/3Mn2/3O2 as high capacity sodium-ion cathode using reversible oxygen redox

Bohang Song, Enyuan Hu, Jue Liu, Yiman Zhang, Xiao-Qing Yang, Jagjit Nanda, Ashfia Huq and Katharine Page

J. Mater. Chem. A, 2019, 7, 1491
DOI: 10.1039/C8TA09422E

The role of metal substitutions in the development of Li batteries, part I: cathodes

Alex Hebert and Eric McCalla

Mater. Adv., 2021, 2, 3474
DOI: 10.1039/D1MA00081K

Approaching theoretical specific capacity of iron-rich lithium iron silicate using graphene-incorporation and fluorine-doping

Tianwei Liu, Yadong Liu, Yikang Yu, Yang Ren, Chengjun Sun, Yuzi Liu, Jiayi Xu, Cong Liu, Zhenzhen Yang, Wenquan Lu, Paulo Ferreira, Zisheng Chao and Jian Xie

J. Mater. Chem. A, 2022, 10, 4006
DOI: 10.1039/D1TA09417C

High-rate stability of Na3V2(PO4)2F3 sodium-ion cathode materials enabled by an entropy-increasing strategy

Peifeng Wang, Zhuohui Sun, Kai Zhang, Hongwei Zhang, Xianghua Yao and Youlong Xu

J. Mater. Chem. A, 2025, 13, 25855
DOI: 10.1039/D5TA02224J

Ab initiostudy of short-range ordering in vanadium-based disordered rocksalt structures

Zinab Jadidi, Julia H. Yang, Tina Chen, Luis Barroso-Luque and Gerbrand Ceder

J. Mater. Chem. A, 2023, 11, 17728
DOI: 10.1039/D3TA02475J

Polymerization inspired synthesis of MnO@carbon nanowires with long cycling stability for lithium ion battery anodes: growth mechanism and electrochemical performance

Fang Zhou, Shuangfu Li, Kai Han, Yajuan Li and You-Nian Liu

Dalton Trans., 2021, 50, 535
DOI: 10.1039/D0DT03540H

High energy density and micrometer-sized d0-free disordered rocksalt cathodes

Vincent C. Wu, Erick A. Lawrence, Tianyu Li, Euan N. Bassey, Chia-Yu Chang, Bing Joe Hwang, Pierre-Etienne Cabelguen and Raphaële J. Clément

Energy Environ. Sci., 2025, 18, 8918
DOI: 10.1039/D5EE01564B

Experimental considerations to study Li-excess disordered rock salt cathode materials

Hyeseung Chung, Zachary Lebens-Higgins, Baharak Sayahpour, Carlos Mejia, Antonin Grenier, Gabrielle E. Kamm, Yixuan Li, Ricky Huang, Louis F. J. Piper, Karena W. Chapman, Jean-Marie Doux and Ying Shirley Meng

J. Mater. Chem. A, 2021, 9, 1720
DOI: 10.1039/D0TA07836K

Effect of fluorination and Li-excess on the Li migration barrier in Mn-based cathode materials

Zinab Jadidi, Tina Chen, Penghao Xiao, Alexander Urban and Gerbrand Ceder

J. Mater. Chem. A, 2020, 8, 19965
DOI: 10.1039/D0TA06415G

Thermochemistry of cation disordered Li ion battery cathode materials, (M′ = Nb and Ta, M′′ = Mn and Fe)

Tamilarasan Subramani and Alexandra Navrotsky

RSC Adv., 2020, 10, 6540
DOI: 10.1039/C9RA09759G

Under pressure: offering fundamental insight into structural changes on ball milling battery materials

Laura L. Driscoll, Elizabeth H. Driscoll, Bo Dong, Farheen N. Sayed, Jacob N. Wilson, Christopher A. O’Keefe, Dominic J. Gardner, Clare P. Grey, Phoebe K. Allan, Adam A. L. Michalchuk and Peter R. Slater

Energy Environ. Sci., 2023, 16, 5196
DOI: 10.1039/D3EE00249G

On stability and kinetics of Li-rich transition metal oxides and oxyfluorides

Holger Euchner, Jin Hyun Chang and Axel Groß

J. Mater. Chem. A, 2020, 8, 7956
DOI: 10.1039/D0TA01054E

Anionic redox reactions and structural degradation in a cation-disordered rock-salt Li1.2Ti0.4Mn0.4O2 cathode material revealed by solid-state NMR and EPR

Fushan Geng, Bei Hu, Chao Li, Chong Zhao, Olivier Lafon, Julien Trébosc, Jean-Paul Amoureux, Ming Shen and Bingwen Hu

J. Mater. Chem. A, 2020, 8, 16515
DOI: 10.1039/D0TA03358H

Regulating d0 transition metals and facilitating high-performance Li-excess cation-disordered rock salt cathode materials

Hui Song, Wenyong Xie, Yinfeng Tian, Min Guo, Tao Wang, Dianwu Kang, Min Jia and Xiaoyu Zhang

J. Mater. Chem. A, 2024, 12, 15154
DOI: 10.1039/D4TA01491J

Understanding cation-disordered rocksalt oxyfluoride cathodes

Dongchang Chen, Juhyeon Ahn, Ethan Self, Jagjit Nanda and Guoying Chen

J. Mater. Chem. A, 2021, 9, 7826
DOI: 10.1039/D0TA12179G

Achieving reversible Mn2+/Mn4+ double redox couple through anionic substitution in a P2-type layered oxide cathode

Haolv Hu, Hung-Chieh He, Rue-Kun Xie, Chen Cheng, Tianran Yan, Chi Chen, Dan Sun, Ting-Shan Chan, Jinpeng Wu and Liang Zhang

Nano Energy, 2022, 99, 107390
DOI: 10.1016/j.nanoen.2022.107390

Thermodynamically Driven Synthetic Optimization for Cation‐Disordered Rock Salt Cathodes

Zijian Cai, Ya‐Qian Zhang, Zhengyan Lun, Bin Ouyang, Leighanne C. Gallington, Yingzhi Sun, Han‐Ming Hau, Yu Chen, Mary C. Scott and Gerbrand Ceder

Advanced Energy Materials, 2022, 12
DOI: 10.1002/aenm.202103923

Towards High‐Performance Li‐Rich Cathode Materials: from Morphology Design to Electronic Structure Modulation

Jing‐Zhe Wan, Chao Ma, Jie‐Sheng Chen and Kai‐Xue Wang

Small, 2025, 21
DOI: 10.1002/smll.202408839

Role of Redox‐Inactive Transition‐Metals in the Behavior of Cation‐Disordered Rocksalt Cathodes

Dongchang Chen, Jinpeng Wu, Joseph K. Papp, Bryan D. McCloskey, Wanli Yang and Guoying Chen

Small, 2020, 16
DOI: 10.1002/smll.202000656

Plum pudding model inspired KVPO4F@3DC as high-voltage and hyperstable cathode for potassium ion batteries

Zhaomeng Liu, Jue Wang and Bingan Lu

Science Bulletin, 2020, 65, 1242
DOI: 10.1016/j.scib.2020.04.010

Activation and Stabilization of Mn‐Based Positive Electrode Materials by Doping Nonmetallic Elements

Yuji Mahara, Hideaki Oka, Takamasa Nonaka, Satoru Kosaka, Naoko Takechi Takahashi, Yasuhito Kondo and Yoshinari Makimura

Advanced Energy Materials, 2023, 13
DOI: 10.1002/aenm.202301843

Delocalized Metal–Oxygen π-Redox Is the Origin of Anomalous Nonhysteretic Capacity in Li-Ion and Na-Ion Cathode Materials

Daniil A. Kitchaev, Julija Vinckeviciute and Anton Van der Ven

J. Am. Chem. Soc., 2021, 143, 1908
DOI: 10.1021/jacs.0c10704

Physicochemical Design Principles Enabling High-Energy and -Power Low-Cost Na Storage Materials

Hyungjun Kim, Myungkyu Kim, Duho Kim and Maenghyo Cho

J. Phys. Chem. C, 2021, 125, 3305
DOI: 10.1021/acs.jpcc.0c10901

A medium-entropy transition metal oxide cathode for high-capacity lithium metal batteries

Yi Pei, Qing Chen, Meiyu Wang, Pengjun Zhang, Qingyong Ren, Jingkai Qin, Penghao Xiao, Li Song, Yu Chen, Wen Yin, Xin Tong, Liang Zhen, Peng Wang and Cheng-Yan Xu

Nat Commun, 2022, 13
DOI: 10.1038/s41467-022-33927-0

Improved Cycling Performance of Cation-Disordered Rock-Salt Li1.2Ti0.4Mn0.4O2 Cathode through Mo-Doping and Al2O3-Coating

Zongchang Li, Zhihao Zhang, Baojun Huang, Huanwen Wang, Beibei He, Yansheng Gong, Jun Jin and Rui Wang

Coatings, 2022, 12, 1613
DOI: 10.3390/coatings12111613

Optimizing Disordered Rock Salt Cathodes by Solid‐State Synthesis and Design of Experiments for Enhanced Battery Performance

Eduardo C. M. Barbosa, Jianxuan Du, Avnish Singh Pal, Aleksandr Kondrakov and Torsten Brezesinski

Advanced Sustainable Systems, 2025, 9
DOI: 10.1002/adsu.202400931

Improved Cycling Performance of Li‐Excess Cation‐Disordered Cathode Materials upon Fluorine Substitution

Zhengyan Lun, Bin Ouyang, Daniil A. Kitchaev, Raphaële J. Clément, Joseph K. Papp, Mahalingam Balasubramanian, Yaosen Tian, Teng Lei, Tan Shi, Bryan D. McCloskey, Jinhyuk Lee and Gerbrand Ceder

Advanced Energy Materials, 2019, 9
DOI: 10.1002/aenm.201802959

Long-Term Cycle Stability Enabled by the Incorporation of Ni into Li2MnO3 Phase in the Mn-Based Li-Rich Layered Materials

Junghwa Lee, Yue Gong, Lin Gu and Byoungwoo Kang

ACS Energy Lett., 2021, 6, 789
DOI: 10.1021/acsenergylett.1c00057

Atomic-scale probing of short-range order and its impact on electrochemical properties in cation-disordered oxide cathodes

Linze Li, Bin Ouyang, Zhengyan Lun, Haoyan Huo, Dongchang Chen, Yuan Yue, Colin Ophus, Wei Tong, Guoying Chen, Gerbrand Ceder and Chongmin Wang

Nat Commun, 2023, 14
DOI: 10.1038/s41467-023-43356-2

Strategies to Achieve Stable Manganese Oxyfluorides by Tuning the Reactivity of Pure Molecular Fluorine

Sebastien De Windt, Jérémie Auvergniot, Pierre-Etienne Cabelguen, Fabienne Gschwind, Marc Dubois and Katia Guerin

Inorg. Chem., 2023, 62, 19612
DOI: 10.1021/acs.inorgchem.3c02982

Deep learning of experimental electrochemistry for battery cathodes across diverse compositions

Peichen Zhong, Bowen Deng, Tanjin He, Zhengyan Lun and Gerbrand Ceder

Joule, 2024, 8, 1837
DOI: 10.1016/j.joule.2024.03.010

Effect of Fluorine Substitution on the Electrochemical Property and Structural Stability of a Lithium-Excess Cation Disordered Rock-Salt Cathode

Panpan Li, Zhijie Feng, Tao Cheng, Yingchun Lyu and Bingkun Guo

Chinese Phys. Lett., 2021, 38, 088201
DOI: 10.1088/0256-307X/38/8/088201

A Design Strategy for Durable Anionic Redox via Fluorine‐Induced Electronic Structure Modulation in In Situ Formed Disordered Phases

Wontae Lee, Yun Seong Byeon, Kyeongkeun Kwon, Jae‐Uk Kim, Seongeun Lee, Dong Ki Kim, Bo Gyu Jang, Min‐Sik Park and Won‐Sub Yoon

Advanced Materials, 2026
DOI: 10.1002/adma.202518963

Stabilization of Oxygen‐Dependent Fe3+/4+ Redox in Li‐Excess DRX Cathode Exhibiting Anionic Redox via Transition Metal Combination

Hayeon Lee, Minji Kim, Hyunyoung Park, Yiseul Yoo, Sangmun Na, Hee‐Dae Lim, Jongsoon Kim and Won‐Sub Yoon

Adv Funct Materials, 2024, 34
DOI: 10.1002/adfm.202312401

Nanoscale Phenomena in Lithium-Ion Batteries

Sung-Kyun Jung, Insang Hwang, Donghee Chang, Kyu-Young Park, Sung Joo Kim, Won Mo Seong, Donggun Eum, Jooha Park, Byunghoon Kim, Jihyeon Kim, Jae Hoon Heo and Kisuk Kang

Chem. Rev., 2020, 120, 6684
DOI: 10.1021/acs.chemrev.9b00405

Data-driven design of high-energy-density disordered rock-salt cathode via a physically informed graph neural network

Yujian Sun, Xiaoyu Zhou, Sichen Jiao, Rui Liu, Zhengyan Lun, Huican Mao, Xiqian Yu and Hong Li

Energy Storage Materials, 2026, 89, 105248
DOI: 10.1016/j.ensm.2026.105248

Synthesis-driven electron transfer in disordered rock salt Li-ion battery cathodes

Khem Prasad Bhurtel, Jing Yang, Chuzhong Zhang, Angelica Benavidez, Rui Liu, Basirat Raji-Adefila, Dennis Nordlund, Di Zhang, Changjian Feng and Dongchang Chen

Nano Energy, 2026, 151, 111841
DOI: 10.1016/j.nanoen.2026.111841

Enhanced Cycling Stability of Cation Disordered Rock-Salt Li1.2Ti0.4Mn0.4O2 Material by Surface Modification With Al2O3

Baojun Huang, Rui Wang, Yansheng Gong, Beibei He and Huanwen Wang

Front. Chem., 2019, 7
DOI: 10.3389/fchem.2019.00107

Phase Transition Induced Enhanced Performance of Sodium-Rich Na1.2Mn0.8O2–yFy (y = 0–0.5) Cathodes

Bala Krishnan Ganesan and Yun-Sung Lee

ACS Appl. Energy Mater., 2023, 6, 960
DOI: 10.1021/acsaem.2c03391

Kinetics of Li Transport in Vanadium-Based Disordered Rocksalt Structures

Zinab Jadidi, Tina Chen, Luis Barroso-Luque and Gerbrand Ceder

Chem. Mater., 2023, 35, 9225
DOI: 10.1021/acs.chemmater.3c01941

First-Principles Study of the Effect of Ni-Doped on the Spinel-Type Mn-Based Cathode Discharge

Jiexiang Li, Min Yang, Xiaoming Zhang, Jiawei Wen, Chunxia Wang, Guoyong Huang and Weiyu Song

ACS Appl. Mater. Interfaces, 2023, 15, 8208
DOI: 10.1021/acsami.2c22188

Oxygen Activity in Li-Rich Disordered Rock-Salt Oxide and the Influence of LiNbO3 Surface Modification on the Electrochemical Performance

Musa Ali Cambaz, Bhaghavathi P. Vinayan, Holger Geßwein, Alexander Schiele, Angelina Sarapulova, Thomas Diemant, Andrey Mazilkin, Torsten Brezesinski, R. Jürgen Behm, Helmut Ehrenberg and Maximilian Fichtner

Chem. Mater., 2019, 31, 4330
DOI: 10.1021/acs.chemmater.8b04504

A Two-Step Oxidation Mechanism Controlled by Mn Migration Explains the First-Cycle Activation Behavior of Li2MnO3-Based Li-Excess Materials

Julija Vinckeviciute, Daniil A. Kitchaev and Anton Van der Ven

Chem. Mater., 2021, 33, 1625
DOI: 10.1021/acs.chemmater.0c03734

Tailoring the redox-active transition metal content to enhance cycling stability in cation-disordered rock-salt oxides

Ke Zhou, Yining Li, Shiyao Zheng, Maojie Zhang, Chunyang Zhang, Corsin Battaglia, Haodong Liu, Kuan Wang, Pengfei Yan, Jianjun Liu and Yong Yang

Energy Storage Materials, 2021, 43, 275
DOI: 10.1016/j.ensm.2021.08.045

Advancing Mn-Based Li-Ion Battery Cathodes via a Partially Cation-Disordered Zigzag-Type Li–Nb–Mn–O Framework

You Wang, Wonu Choe, Yong Ding, Rui Liu, Dennis Nordlund and Dongchang Chen

J. Am. Chem. Soc., 2025, 147, 13437
DOI: 10.1021/jacs.5c00139

Enabling high areal capacity for Co-free high voltage spinel materials in next-generation Li-ion batteries

Weikang Li, Yoon-Gyo Cho, Weiliang Yao, Yixuan Li, Ashley Cronk, Ryosuke Shimizu, Marshall A. Schroeder, Yanbao Fu, Feng Zou, Vince Battaglia, Arumugam Manthiram, Minghao Zhang and Ying Shirley Meng

Journal of Power Sources, 2020, 473, 228579
DOI: 10.1016/j.jpowsour.2020.228579

Research Progress in Lithium‐Excess Disordered Rock‐Salt Oxides Cathode

Manxi Wang, Xiaochuan Chen, Hurong Yao, Ganggang Lin, Jinhyuk Lee, Yuming Chen and Qinghua Chen

Energy & Environ Materials, 2022, 5, 1139
DOI: 10.1002/eem2.12413

Selective Formation of the Li4Mn5O12 Surface Spinel Phase in Sulfur-Doped Li-Excess-Layered Cathode Materials for Improved Cycle Life

Yongju Lee, Tae-Hee Kim, Young-Kyun Kwon, Jaewook Shin and EunAe Cho

ACS Sustainable Chem. Eng., 2020, 8, 8037
DOI: 10.1021/acssuschemeng.0c02687

Tuning magnetic antiskyrmion stability in tetragonal inverse Heusler alloys

Daniil A. Kitchaev and Anton Van der Ven

Phys. Rev. Materials, 2021, 5
DOI: 10.1103/PhysRevMaterials.5.124408

Exploring the Properties of Disordered Rocksalt Battery Cathode Materials by Advanced Characterization

Roujia Chen, Chu Lun Alex Leung and Chun Huang

Adv Funct Materials, 2024, 34
DOI: 10.1002/adfm.202308165

An Overview of Cation-Disordered Lithium-Excess Rocksalt Cathodes

Dongchang Chen, Juhyeon Ahn and Guoying Chen

ACS Energy Lett., 2021, 1358
DOI: 10.1021/acsenergylett.1c00203

Synthesis and Redox Mechanism of Cation-Disordered, Rock-Salt Cathode-Material Li–Ni–Ti–Nb–O Compounds for a Li-Ion Battery

Zhenlu Yu, Xingyu Qu, Aichun Dou, Mingru Su, Yunjian Liu and Feixiang Wu

ACS Appl. Mater. Interfaces, 2019, 11, 35777
DOI: 10.1021/acsami.9b12822

Fluorination‐Enhanced Surface Stability of Disordered Rocksalt Cathodes

Linze Li, Juhyeon Ahn, Yuan Yue, Wei Tong, Guoying Chen and Chongmin Wang

Advanced Materials, 2022, 34
DOI: 10.1002/adma.202106256

Quantitative measurement of solid electrolyte interphase growth on Si-based anode materials

Zilai Yan, Yijia Liu, T.D. Hatchard, Benjamin Scott, Yidan Cao, Simeng Cao and M.N. Obrovac

Journal of Power Sources, 2022, 530, 231281
DOI: 10.1016/j.jpowsour.2022.231281

Reversible cationic-anionic redox in disordered rocksalt cathodes enabled by fluorination-induced integrated structure design

Feng Wu, Jinyang Dong, Jiayu Zhao, Qi Shi, Yun Lu, Ning Li, Duanyun Cao, Wenbo Li, Jianan Hao, Yu Zheng, Lai Chen and Yuefeng Su

Journal of Energy Chemistry, 2023, 82, 158
DOI: 10.1016/j.jechem.2023.03.048

Frontiers of Chemical Space

Rahul Malik

Joule, 2018, 2, 1403
DOI: 10.1016/j.joule.2018.07.034

Constructing multicomponent cluster expansions with machine-learning and chemical embedding

Yann L. Müller and Anirudh Raju Natarajan

npj Comput Mater, 2025, 11
DOI: 10.1038/s41524-025-01543-3

Review—Recent Progress of Lithium-Rich Cation Disordered Rocksalt Cathode for High Performance Lithium-Ion Batteries

Jiashuai Wang, Zhaokun Wang, Haofeng Shi, Chengdeng Wang, Zhi Wang, Yan Gao, Zhiming Bai and Xiaoqin Yan

J. Electrochem. Soc., 2024, 171, 040527
DOI: 10.1149/1945-7111/ad3aea

Reviewing Li-Rich Disordered Rocksalts as Next-Generation High-Energy Cathode Material

Sayandeep Guin, Subham Ghosh, Susim Sabuj Sarkar and Urmimala Maitra

Chem. Mater., 2024, 36, 10421
DOI: 10.1021/acs.chemmater.4c00469

Carbon-coated cation-disordered rocksalt-type transition metal oxide composites for high energy Li-ion batteries

Zhenlu Yu, Xingyu Qu, Aichun Dou, Yu Zhou, Mingru Su and Yunjian Liu

Ceramics International, 2021, 47, 1758
DOI: 10.1016/j.ceramint.2020.09.001

Alternate Synthesis Method for High‐Performance Manganese Rich Cation Disordered Rocksalt Cathodes

Shripad Patil, Devendrasinh Darbar, Ethan C. Self, Thomas Malkowski, Vincent C. Wu, Raynald Giovine, Nathan J. Szymanski, Rebecca D. McAuliffe, Bo Jiang, Jong K. Keum, Krishna P. Koirala, Bin Ouyang, Katharine Page, Chongmin Wang, Gerbrand Ceder, Raphaële J. Clément and Jagjit Nanda

Advanced Energy Materials, 2023, 13
DOI: 10.1002/aenm.202203207

Structural and Chemical Evolution of Highly Fluorinated Li‐Rich Disordered Rocksalt Oxyfluorides as a Function of Temperature

Neelam Sunariwal, Fulya Dogan, Indrani Roy, Khagesh Kumar, Dennis Nordlund, Qing Ma and Jordi Cabana

Adv Funct Materials, 2024, 34
DOI: 10.1002/adfm.202312010

Understanding the Fluorination of Disordered Rocksalt Cathodes through Rational Exploration of Synthesis Pathways

Nathan J. Szymanski, Yan Zeng, Tyler Bennett, Shripad Patil, Jong K. Keum, Ethan C. Self, Jianming Bai, Zijian Cai, Raynald Giovine, Bin Ouyang, Feng Wang, Christopher J. Bartel, Raphaële J. Clément, Wei Tong, Jagjit Nanda and Gerbrand Ceder

Chem. Mater., 2022, 34, 7015
DOI: 10.1021/acs.chemmater.2c01474

Fluorination‐Enhanced Surface Stability of Cation‐Disordered Rocksalt Cathodes for Li‐Ion Batteries

Linze Li, Zhengyan Lun, Dongchang Chen, Yuan Yue, Wei Tong, Guoying Chen, Gerbrand Ceder and Chongmin Wang

Adv Funct Materials, 2021, 31
DOI: 10.1002/adfm.202101888

How Fluorine Introduction Solves the Spinel Transition, a Fundamental Problem of Mn-Based Positive Electrodes

Yuji Mahara, Naoyuki Nagasako, Hideaki Oka, Yasuhito Kondo, Satoru Kosaka, Hiroyuki Nakano, Takamasa Nonaka and Yoshinari Makimura

ACS Appl. Mater. Interfaces, 2022, 14, 24321
DOI: 10.1021/acsami.2c02868

Enhanced Li+ Diffusion and Lattice oxygen Stability by the High Entropy Effect in Disordered‐Rocksalt Cathodes

Shuyu Zhou, Yuxuan Sun, Tong Gao, Junhong Liao, Shixi Zhao and Guozhong Cao

Angew Chem Int Ed, 2023, 62
DOI: 10.1002/anie.202311930

Short-Range Order and Unusual Modes of Nickel Redox in a Fluorine-Substituted Disordered Rocksalt Oxide Lithium-Ion Cathode

Raphaële J. Clément, Daniil Kitchaev, Jinhyuk Lee and Gerbrand Ceder

Chem. Mater., 2018, 30, 6945
DOI: 10.1021/acs.chemmater.8b03794

Synthesis and electrochemical properties of cation‐disordered rock‐salt x Li 3 NbO 4 ·(1 − x ) NiO compounds for Li‐ion batteries

Zongjian Wu, Qi Luo, Lin Lin, Wei Yang, Hanbo Zou, Haijun Yu and Shengzhou Chen

Int J Energy Res, 2021, 45, 3966
DOI: 10.1002/er.6050

Synthesis of iron-titanium disordered rock salt high-performance cathode materials with δ phase transition via aqueous gels

Shiping Ding, Jiannan Hu, Jianzhong Li, Kai Yu and Junjie Shi

Journal of Power Sources, 2025, 656, 238106
DOI: 10.1016/j.jpowsour.2025.238106

Effect of Disorder and Doping on Electronic Structure and Diffusion Properties of Li3V2O5

Mohammad Babar, Hasnain Hafiz, Zeeshan Ahmad, Bernardo Barbiellini, Arun Bansil and Venkatasubramanian Viswanathan

J. Phys. Chem. C, 2022, 126, 15549
DOI: 10.1021/acs.jpcc.2c03345

Computational Investigation and Experimental Realization of Disordered High-Capacity Li-Ion Cathodes Based on Ni Redox

Huiwen Ji, Daniil A. Kitchaev, Zhengyan Lun, Hyunchul Kim, Emily Foley, Deok-Hwang Kwon, Yaosen Tian, Mahalingam Balasubramanian, Matteo Bianchini, Zijian Cai, Raphaële J. Clément, Jae Chul Kim and Gerbrand Ceder

Chem. Mater., 2019, 31, 2431
DOI: 10.1021/acs.chemmater.8b05096

CASM Monte Carlo: Calculations of the thermodynamic and kinetic properties of complex multicomponent crystals

Brian Puchala, John C. Thomas and Anton Van der Ven

Computational Materials Science, 2025, 260, 114091
DOI: 10.1016/j.commatsci.2025.114091

Rational design of high reversible capacity in Li-rich disordered rocksalt cathodes

Yining Li, Yi Li, Haoxin Li, Yang Gan, Wujie Qiu and Jianjun Liu

Nano Energy, 2024, 119, 109064
DOI: 10.1016/j.nanoen.2023.109064

Determining the Criticality of Li‐Excess for Disordered‐Rocksalt Li‐Ion Battery Cathodes

Jinhyuk Lee, Chao Wang, Rahul Malik, Yanhao Dong, Yimeng Huang, Dong‐Hwa Seo and Ju Li

Advanced Energy Materials, 2021, 11
DOI: 10.1002/aenm.202100204

Research progress and prospect in element doping of lithium-rich layered oxides as cathode materials for lithium-ion batteries

Dou Shumei, Tan Dan, Li Ping, Li Huiqin, Wei Fenyan and Hongge Zhang

J Solid State Electrochem, 2023, 27, 1
DOI: 10.1007/s10008-022-05294-9

Predicting Short-Range Order in Disordered Rocksalt Li-Oxide Cathode Materials with Density Functional Theory and Crystal Graph Neural Networks

R. Seaton Ullberg, John D. Langhout, Megan M. Butala and Simon R. Phillpot

ACS Appl. Energy Mater., 2026, 9, 3703
DOI: 10.1021/acsaem.5c02676

Design Principles for High-Capacity Mn-Based Cation-Disordered Rocksalt Cathodes

Zhengyan Lun, Bin Ouyang, Zijian Cai, Raphaële J. Clément, Deok-Hwang Kwon, Jianping Huang, Joseph K. Papp, Mahalingam Balasubramanian, Yaosen Tian, Bryan D. McCloskey, Huiwen Ji, Haegyeom Kim, Daniil A. Kitchaev and Gerbrand Ceder

Chem, 2020, 6, 153
DOI: 10.1016/j.chempr.2019.10.001

Investigating Particle Size‐Dependent Redox Kinetics and Charge Distribution in Disordered Rocksalt Cathodes

Yuxin Zhang, Anyang Hu, Jue Liu, Zhengrui Xu, Linqin Mu, Sami Sainio, Dennis Nordlund, Luxi Li, Cheng‐Jun Sun, Xianghui Xiao, Yijin Liu and Feng Lin

Adv Funct Materials, 2022, 32
DOI: 10.1002/adfm.202110502

In situ analysis of gas evolution in liquid- and solid-electrolyte-based batteries with current and next-generation cathode materials

Sören L. Dreyer, Aleksandr Kondrakov, Jürgen Janek and Torsten Brezesinski

Journal of Materials Research, 2022, 37, 3146
DOI: 10.1557/s43578-022-00586-2

Structural and Electrochemical Investigation of Ni- and Mn-Based Disordered Rock Salt Cathode Materials without d0 Elements

Agnese Reitano, Mahsa Emamjomeh, Emmanuelle Suard, Ulrich Mansfeld, Carlo Marini and Matteo Bianchini

ACS Appl. Mater. Interfaces, 2026, 18, 8393
DOI: 10.1021/acsami.5c18817

Effect of Fluorination on Lithium Transport and Short‐Range Order in Disordered‐Rocksalt‐Type Lithium‐Ion Battery Cathodes

Bin Ouyang, Nongnuch Artrith, Zhengyan Lun, Zinab Jadidi, Daniil A. Kitchaev, Huiwen Ji, Alexander Urban and Gerbrand Ceder

Advanced Energy Materials, 2020, 10
DOI: 10.1002/aenm.201903240

An Experimental Approach to Assess Fluorine Incorporation into Disordered Rock Salt Oxide Cathodes

Raynald Giovine, Eric Yoshida, Vincent C. Wu, Yuefan Ji, Matthew J. Crafton, Bryan D. McCloskey and Raphaële J. Clément

Chem. Mater., 2024, 36, 3643
DOI: 10.1021/acs.chemmater.3c03138

Modeling Short-Range Order in Disordered Rocksalt Cathodes by Pair Distribution Function Analysis

Nathan J. Szymanski, Zhengyan Lun, Jue Liu, Ethan C. Self, Christopher J. Bartel, Jagjit Nanda, Bin Ouyang and Gerbrand Ceder

Chem. Mater., 2023, 35, 4922
DOI: 10.1021/acs.chemmater.2c03827

How inactive d0 transition metal controls anionic redox in disordered Li-rich oxyfluoride cathodes

Yining Li, Xiaolin Zhao, Qisheng Bao, Mengnan Cui, Wujie Qiu and Jianjun Liu

Energy Storage Materials, 2020, 32, 253
DOI: 10.1016/j.ensm.2020.07.013

Fluorine-modified Li-rich disordered rock salt cathodes for stable high-capacity lithium batteries

Sitian Song, Yun Ye, Zhixuan Fu, Lei Zhou, Huaizhe Li and Shuang Yuan

Journal of Alloys and Compounds, 2026, 1056, 186574
DOI: 10.1016/j.jallcom.2026.186574

Anion Doping for Layered Oxides with a Solid-Solution Reaction for Potassium-Ion Battery Cathodes

Yan-Song Xu, Mu-Yao Qi, Qing-Hua Zhang, Fan-Qi Meng, Yong-Ning Zhou, Si-Jie Guo, Yong-Gang Sun, Lin Gu, Bao-Bao Chang, Chun-Tai Liu, An-Min Cao and Li-Jun Wan

ACS Appl. Mater. Interfaces, 2022, 14, 13379
DOI: 10.1021/acsami.2c00811

Over‐Stoichiometric Metastabilization of Cation‐Disordered Rock Salts

You Wang, Alexandra Outka, Wassie Mersha Takele, Maxim Avdeev, Sami Sainio, Rui Liu, Vanessa Kee, Wonu Choe, Basirat Raji‐Adefila, Dennis Nordlund, Shan Zhou, Wang Hay Kan, Terefe G. Habteyes and Dongchang Chen

Advanced Materials, 2023, 35
DOI: 10.1002/adma.202306396

A Fluorination Method for Improving Cation‐Disordered Rocksalt Cathode Performance

Juhyeon Ahn, Dongchang Chen and Guoying Chen

Advanced Energy Materials, 2020, 10
DOI: 10.1002/aenm.202001671

Optimizing Li‐Excess Cation‐Disordered Rocksalt Cathode Design Through Partial Li Deficiency

Liliang Huang, Peichen Zhong, Yang Ha, Zijian Cai, Young‐Woon Byeon, Tzu‐Yang Huang, Yingzhi Sun, Fengyu Xie, Han‐Ming Hau, Haegyeom Kim, Mahalingam Balasubramanian, Bryan D. McCloskey, Wanli Yang and Gerbrand Ceder

Advanced Energy Materials, 2023, 13
DOI: 10.1002/aenm.202202345

Fluorinated Rocksalt‐Polyanion Cathode for Lithium‐Ion Batteries

Yimeng Huang, Yaoshen Niu, Zhen Zhang, Zihan Lin, Weiyin Chen, Vivienne Yiwei Liu, Iradwikanari Waluyo, Adrian Hunt, Xianghui Xiao, Yanhao Dong and Ju Li

Interdisciplinary Materials, 2025, 4, 860
DOI: 10.1002/idm2.70015

Exceptional Cycling Performance Enabled by Local Structural Rearrangements in Disordered Rocksalt Cathodes

Juhyeon Ahn, Yang Ha, Rohit Satish, Raynald Giovine, Linze Li, Jue Liu, Chongmin Wang, Raphaele J. Clement, Robert Kostecki, Wanli Yang and Guoying Chen

Advanced Energy Materials, 2022, 12
DOI: 10.1002/aenm.202200426

Approaches for handling high-dimensional cluster expansions of ionic systems

Julia H. Yang, Tina Chen, Luis Barroso-Luque, Zinab Jadidi and Gerbrand Ceder

npj Comput Mater, 2022, 8
DOI: 10.1038/s41524-022-00818-3

Fluorinated Rocksalt Cathode with Ultra‐high Active Li Content for Lithium‐ion Batteries

Yi Pei, Qing Chen, Yang Ha, Dong Su, Hua Zhou, Shuang Li, Zhenpeng Yao, Lu Ma, Kevin J. Sanders, Chuanchao Sheng, Gillian R. Goward, Lin Gu, Aiping Yu, Wanli Yang and Zhongwei Chen

Angew Chem Int Ed, 2022, 61
DOI: 10.1002/anie.202212471

Hard X-ray spectroscopic methods using emitted X-ray to understand charge compensation in positive electrode materials for lithium-ion batteries

Yusaku F. Nishimura, Hideaki Oka, Takamasa Nonaka, Yoshinari Makimura and Kazuhiko Dohmae

Journal of Power Sources, 2019, 434, 226721
DOI: 10.1016/j.jpowsour.2019.226721

The Impact of Surface Structure Transformations on the Performance of Li-Excess Cation-Disordered Rocksalt Cathodes

Deok-Hwang Kwon, Jinhyuk Lee, Nongnuch Artrith, Hyunchul Kim, Lijun Wu, Zhengyan Lun, Yaosen Tian, Yimei Zhu and Gerbrand Ceder

Cell Reports Physical Science, 2020, 1, 100187
DOI: 10.1016/j.xcrp.2020.100187

Reversible Mn/Cr dual redox in cation-disordered Li-excess cathode materials for stable lithium ion batteries

Xuerong Zheng, Zhengrui Xu, Shaofeng Li, Yuxin Zhang, Jinfeng Zhang, Chunguang Kuai, Lei Tao, Muhammad Mominur Rahman, Yan Zhang, Sang-Jun Lee, Cheng-Jun Sun, Luxi Li, Wenbin Hu, Dennis Nordlund, Jue Liu, Yijin Liu and Feng Lin

Acta Materialia, 2021, 212, 116935
DOI: 10.1016/j.actamat.2021.116935

Anionic Redox in Rechargeable Batteries: Mechanism, Materials, and Characterization

Tianwei Cui, Xiang Li and Yongzhu Fu

Adv Funct Materials, 2023, 33
DOI: 10.1002/adfm.202303191

Enhanced Li+ Diffusion and Lattice oxygen Stability by the High Entropy Effect in Disordered‐Rocksalt Cathodes

Shuyu Zhou, Yuxuan Sun, Tong Gao, Junhong Liao, Shixi Zhao and Guozhong Cao

Angewandte Chemie, 2023, 135
DOI: 10.1002/ange.202311930

Suppressing Dissolution of Vanadium from Cation-Disordered Li2–xVO2F via a Concentrated Electrolyte Approach

Musa Ali Cambaz, Bhaghavathi P. Vinayan, Syed Atif Pervez, Rune E. Johnsen, Holger Geßwein, Alexander A. Guda, Yury V. Rusalev, Michael Kiarie Kinyanjui, Ute Kaiser and Maximilian Fichtner

Chem. Mater., 2019, 31, 7941
DOI: 10.1021/acs.chemmater.9b02074

Rapid and Energy‐Efficient Synthesis of Disordered Rocksalt Cathodes

Vincent C. Wu, Hayden A. Evans, Raynald Giovine, Molleigh B. Preefer, Julia Ong, Eric Yoshida, Pierre‐Etienne Cabelguen and Raphaële J. Clément

Advanced Energy Materials, 2023, 13
DOI: 10.1002/aenm.202203860

Cation-disordered rocksalt-type high-entropy cathodes for Li-ion batteries

Zhengyan Lun, Bin Ouyang, Deok-Hwang Kwon, Yang Ha, Emily E. Foley, Tzu-Yang Huang, Zijian Cai, Hyunchul Kim, Mahalingam Balasubramanian, Yingzhi Sun, Jianping Huang, Yaosen Tian, Haegyeom Kim, Bryan D. McCloskey, Wanli Yang, Raphaële J. Clément, Huiwen Ji and Gerbrand Ceder

Nat. Mater., 2021, 20, 214
DOI: 10.1038/s41563-020-00816-0

Oxygen Vacancy Introduction to Increase the Capacity and Voltage Retention in Li‐Excess Cathode Materials

Jianping Huang, Peichen Zhong, Yang Ha, Zhengyan Lun, Yaosen Tian, Mahalingam Balasubramanian, Wanli Yang and Gerbrand Ceder

Small Structures, 2023, 4
DOI: 10.1002/sstr.202200343

Inhibiting collective cation migration in Li-rich cathode materials as a strategy to mitigate voltage hysteresis

Jianping Huang, Bin Ouyang, Yaqian Zhang, Liang Yin, Deok-Hwang Kwon, Zijian Cai, Zhengyan Lun, Guobo Zeng, Mahalingam Balasubramanian and Gerbrand Ceder

Nat. Mater., 2023, 22, 353
DOI: 10.1038/s41563-022-01467-z

Evolution of Local Structural Ordering and Chemical Distribution upon Delithiation of a Rock Salt–Structured Li1.3Ta0.3Mn0.4O2 Cathode

Wang Hay Kan, Chenxi Wei, Dongchang Chen, Tao Bo, Bao‐Tian Wang, Yan Zhang, Yangchao Tian, Jun‐Sik Lee, Yijin Liu and Guoying Chen

Adv Funct Materials, 2019, 29
DOI: 10.1002/adfm.201808294

Exposure History and its Effect Towards Stabilizing Li Exchange Across Disordered Rock Salt Interfaces

Rohit Satish, Lennart Wichmann, Matthew J. Crafton, Raynald Giovine, Linze Li, Juhyeon Ahn, Yuan Yue, Wei Tong, Guoying Chen, Chongmin Wang, Raphäele J. Clement and Robert Kostecki

ChemElectroChem, 2021, 8, 3982
DOI: 10.1002/celc.202100891

Accelerating cathode material discovery through ab initio random structure searching

Bonan Zhu, Ziheng Lu, Chris J. Pickard and David O. Scanlon

APL Materials, 2021, 9
DOI: 10.1063/5.0076220

Intercalation Chemistry of the Disordered Rocksalt Li3V2O5 Anode from Cluster Expansions and Machine Learning Interatomic Potentials

Xingyu Guo, Chi Chen and Shyue Ping Ong

Chem. Mater., 2023, 35, 1537
DOI: 10.1021/acs.chemmater.2c02839

Order-disorder transition in amorphous Vanadium-Phosphorus-Lithium cathode of lithium ion battery

Fanhou Kong, Dan Sun, Yinzhao Rao, Ruixiang Zhang, Zelin Chen, Dan Wang, Xiaolong Yu, Hong Jiang and Changjiu Li

Applied Surface Science, 2022, 573, 151490
DOI: 10.1016/j.apsusc.2021.151490

Realizing continuous cation order-to-disorder tuning in a class of high-energy spinel-type Li-ion cathodes

Zijian Cai, Huiwen Ji, Yang Ha, Jue Liu, Deok-Hwang Kwon, Yaqian Zhang, Alexander Urban, Emily E. Foley, Raynald Giovine, Hyunchul Kim, Zhengyan Lun, Tzu-Yang Huang, Guobo Zeng, Yu Chen, Jingyang Wang, Bryan D. McCloskey, Mahalingam Balasubramanian, Raphaële J. Clément, Wanli Yang and Gerbrand Ceder

Matter, 2021, 4, 3897
DOI: 10.1016/j.matt.2021.10.013

Constructing and Evaluating Machine-Learned Interatomic Potentials for Li-Based Disordered Rocksalts

Vijay Choyal, Nidhish Sagar and Gopalakrishnan Sai Gautam

J. Chem. Theory Comput., 2024, 20, 4844
DOI: 10.1021/acs.jctc.4c00039

A Roadmap for Transforming Research to Invent the Batteries of the Future Designed within the European Large Scale Research Initiative BATTERY 2030+

Julia Amici, Pietro Asinari, Elixabete Ayerbe, Philippe Barboux, Pascale Bayle‐Guillemaud, R. Jürgen Behm, Maitane Berecibar, Erik Berg, Arghya Bhowmik, Silvia Bodoardo, Ivano E. Castelli, Isidora Cekic‐Laskovic, Rune Christensen, Simon Clark, Ralf Diehm, Robert Dominko, Maximilian Fichtner, Alejandro A. Franco, Alexis Grimaud, Nicolas Guillet, Maria Hahlin, Sarah Hartmann, Vincent Heiries, Kersti Hermansson, Andreas Heuer, Saibal Jana, Lara Jabbour, Josef Kallo, Arnulf Latz, Henning Lorrmann, Ole Martin Løvvik, Sandrine Lyonnard, Marcel Meeus, Elie Paillard, Simon Perraud, Tobias Placke, Christian Punckt, Olivier Raccurt, Janna Ruhland, Edel Sheridan, Helge Stein, Jean‐Marie Tarascon, Victor Trapp, Tejs Vegge, Marcel Weil, Wolfgang Wenzel, Martin Winter, Andreas Wolf and Kristina Edström

Advanced Energy Materials, 2022, 12
DOI: 10.1002/aenm.202102785

Metastable and Nanosized Li_1.2Nb_0.2V_0.6O₂ for High-Energy Li-ion Batteries

Ruijie QI, Benoît D. L. CAMPÉON, Itsuki KONUMA, Yoshihiko SATO, Yuko KANEDA, Masashi KONDO and Naoaki YABUUCHI

Electrochemistry, 2022, 90, 037005
DOI: 10.5796/electrochemistry.22-00005

Manipulating disorder within cathodes of alkali-ion batteries

Seongkoo Kang, Suwon Lee, Hakwoo Lee and Yong-Mook Kang

Nat Rev Chem, 2024, 8, 587
DOI: 10.1038/s41570-024-00622-1

High-energy-density halide and sulfide-based solid-state batteries: Interface engineering and performance optimization

Xuanyi Zhou, Lei Xi, Fangkun Li, Min Zhu, Yu Yao, Yan Yu and Jun Liu

Materials Science and Engineering: R: Reports, 2026, 170, 101235
DOI: 10.1016/j.mser.2026.101235

The Mechanism of Fluorine Doping for the Enhanced Lithium Storage Behavior in Cation‐Disordered Cathode Oxide

Sichen Jiao, Yujian Sun, Junyang Wang, Dekai Shi, Yapei Li, Xiangkang Jiang, Fangwei Wang, Yuanpeng Zhang, Jue Liu, Xuelong Wang, Xiqian Yu, Hong Li, Liquan Chen and Xuejie Huang

Advanced Energy Materials, 2023, 13
DOI: 10.1002/aenm.202301636

Design principles for zero-strain Li-ion cathodes

Xinye Zhao, Yaosen Tian, Zhengyan Lun, Zijian Cai, Tina Chen, Bin Ouyang and Gerbrand Ceder

Joule, 2022, 6, 1654
DOI: 10.1016/j.joule.2022.05.018

Reducing structural degradation of high‐voltage single‐crystal Ni‐rich cathode through in situ doping strategy

Xin‐Ming Fan, Zhi Zhang, Gao‐Qiang Mao, Ying‐Jie Tong, Ke‐Bo Lin, Hui Tong, Wei‐Feng Wei, Qing‐Hua Tian and Xue‐Yi Guo

Rare Metals, 2023, 42, 2993
DOI: 10.1007/s12598-023-02288-y

Non‐Equilibrium Manufacturing for High‐Energy‐Input Solid‐State Battery Materials

Hao Shen, Zhanhui Jia, Yuyang Zhang, Shenghua Chen, Zhenxin Huang, Feier Shangguan, Sujia Yan, Tianyi Zhang, Kai Chen, Weijiang Xue, Yuping Wu, Wei Tang and Ya‐Ling He

Advanced Materials, 2026, 38
DOI: 10.1002/adma.202515467

A New Type of Li‐Rich Rock‐Salt Oxide Li2Ni1/3Ru2/3O3 with Reversible Anionic Redox Chemistry

Xiang Li, Yu Qiao, Shaohua Guo, Kezhu Jiang, Masayoshi Ishida and Haoshen Zhou

Advanced Materials, 2019, 31
DOI: 10.1002/adma.201807825

Next-generation lithium-ion batteries: lithium-rich layered-rocksalt intergrown cathodes enabling high-capacity, high-rate, and long-cycling stability

Xinge Sun, Jianmin Zhang, Siyuan Ma, Shaobo Wu, Xinyu Zhu, Cai Liu, Yuefeng Su, Yongjian Li, Wengang Yan, Lai Chen, Meng Wang, Qing Huang and Ning Li

Energy Storage Materials, 2025, 81, 104505
DOI: 10.1016/j.ensm.2025.104505

Fluorine substitution enabled superior performance of NaxMn2-xO1.5F0.5 (x = 1.05–1.3) type Na-rich cathode

Bala Krishnan Ganesan, Megala Moorthy, Ranjith Thangavel, Kyung-Wan Nam, Vanchiappan Aravindan and Yun-Sung Lee

Chemical Engineering Journal, 2023, 454, 139876
DOI: 10.1016/j.cej.2022.139876

Fundamental understanding of high-capacity lithium-excess cathodes with disordered rock salt structure

Hao Lin, Beatriz Moreno, Kamil Kucuk, Sensen Zhang, Shankar Aryal, Zheng Li, Carlo U. Segre, Jassiel Rodriguez, Dhanya Puthusseri, Lirong Cai, Xuechen Jiao and Vilas G. Pol

Journal of Materials Science & Technology, 2021, 74, 60
DOI: 10.1016/j.jmst.2020.07.041

Cluster expansions of multicomponent ionic materials: Formalism and methodology

Luis Barroso-Luque, Peichen Zhong, Julia H. Yang, Fengyu Xie, Tina Chen, Bin Ouyang and Gerbrand Ceder

Phys. Rev. B, 2022, 106
DOI: 10.1103/PhysRevB.106.144202

Synergetic anion-cation co-doping in Na0.44MnO2 boosting a high-stability and improved-kinetics cathode for sodium ion battery

Tianwei Cui, Xiang Li, Yubing Si and Yongzhu Fu

Energy Storage Materials, 2024, 65, 103161
DOI: 10.1016/j.ensm.2023.103161

Mn4+-Substituted Li-Rich Li1.2Mn0.43+Mnx4+Ti0.4–xO2 Materials with High Energy Density

Shiyao Zheng, Ke Zhou, Feng Zheng, Haodong Liu, Guiming Zhong, Wenhua Zuo, Ningbo Xu, Gang Zhao, Mingzeng Luo, Jue Wu, Chunyang Zhang, Zhongru Zhang, Shunqing Wu and Yong Yang

ACS Appl. Mater. Interfaces, 2020, 12, 40347
DOI: 10.1021/acsami.0c11544

Synthesis and Structure Stabilization of Disordered Rock Salt Mn/V-Based Oxyfluorides as Cathode Materials for Li-Ion Batteries

Iris Blumenhofer, Yasaman Shirazi Moghadam, Abdel El Kharbachi, Yang Hu, Kai Wang and Maximilian Fichtner

ACS Mater. Au, 2023, 3, 132
DOI: 10.1021/acsmaterialsau.2c00064

Unlocking fast Li-ion transport in micrometer-sized Mn-based cation-disordered rocksalt cathodes

Yuchen Zhang, Hao Chen, Runze Yu, Wei Yang, Jia He, Haoyang Li, Xianhu Sun and Zhengyan Lun

Journal of Energy Chemistry, 2024, 99, 645
DOI: 10.1016/j.jechem.2024.08.012

Possible high-potential ilmenite type Na1MO3 (M=V–Ni) cathodes realized by dominant oxygen redox reaction

M. H. N. Assadi, Masashi Okubo, Atsuo Yamada and Yoshitaka Tateyama

Phys. Rev. Materials, 2020, 4
DOI: 10.1103/PhysRevMaterials.4.015401

Identifying the effect of fluorination on cation and anion redox activity in Mn based cation-disordered cathode

Yueyue He, Shuo Wang, Haiyan Zhang, Xin Chen, Jin Li, Huiyuan Xu, Yanhui Zhang, KangHui Hu, Genpin Lv, Yan Meng and Wei Xiang

Journal of Colloid and Interface Science, 2022, 607, 1333
DOI: 10.1016/j.jcis.2021.09.101

Disordered Rocksalts as High‐Energy and Earth‐Abundant Li‐Ion Cathodes

Han‐Ming Hau, Tucker Holstun, Eunryeol Lee, Bernardine L. D. Rinkel, Tara P. Mishra, Max Markuson DiPrince, Rohith Srinivaas Mohanakrishnan, Ethan C. Self, Kristin A. Persson, Bryan D. McCloskey and Gerbrand Ceder

Advanced Materials, 2025, 37
DOI: 10.1002/adma.202502766

Chemomechanical Design Factors for High Performance in Manganese-Based Spinel Cathode Materials for Advanced Sodium-Ion Batteries

Hyungjun Kim, Duho Kim and Maenghyo Cho

ACS Appl. Mater. Interfaces, 2020, 12, 22789
DOI: 10.1021/acsami.0c01687

Maximizing interface stability in all-solid-state lithium batteries through entropy stabilization and fast kinetics

Xiangkun Kong, Run Gu, Zongzi Jin, Lei Zhang, Chi Zhang, Wenyi Xiang, Cui Li, Kang Zhu, Yifan Xu, Huang Huang, Xiaoye Liu, Ranran Peng and Chengwei Wang

Nat Commun, 2024, 15
DOI: 10.1038/s41467-024-51123-0

Interphases, Interfaces, and Surfaces of Active Materials in Rechargeable Batteries and Perovskite Solar Cells

Chaofeng Liu, Jifeng Yuan, Robert Masse, Xiaoxiao Jia, Wenchao Bi, Zachary Neale, Ting Shen, Meng Xu, Meng Tian, Jiqi Zheng, Jianjun Tian and Guozhong Cao

Advanced Materials, 2021, 33
DOI: 10.1002/adma.201905245

Design and Tuning of the Electrochemical Properties of Vanadium-Based Cation-Disordered Rock-Salt Oxide Positive Electrode Material for Lithium-Ion Batteries

Musa Ali Cambaz, Bhaghavathi P. Vinayan, Holger Euchner, Syed Atif Pervez, Holger Geßwein, Tobias Braun, Axel Gross and Maximilian Fichtner

ACS Appl. Mater. Interfaces, 2019, 11, 39848
DOI: 10.1021/acsami.9b12566

Oxygen Redox Chemistry in Rechargeable Li-Ion and Na-Ion Batteries

Muhammad Mominur Rahman and Feng Lin

Matter, 2021, 4, 490
DOI: 10.1016/j.matt.2020.12.004

Tuning Bulk Redox and Altering Interfacial Reactivity in Highly Fluorinated Cation-Disordered Rocksalt Cathodes

Matthew J. Crafton, Tzu-Yang Huang, Yuan Yue, Raynald Giovine, Vincent C. Wu, Chaochao Dun, Jeffrey J. Urban, Raphaële J. Clément, Wei Tong and Bryan D. McCloskey

ACS Appl. Mater. Interfaces, 2023, 15, 18747
DOI: 10.1021/acsami.2c16974

Effect of cooling rate on the structure and electrochemical properties of Mn-based oxyfluorides with cation-disordered rock-salt structure

Kseniya V. Mishchenko, Maria A. Kirsanova, Arseny B. Slobodyuk, Anna A. Krinitsyna and Nina V. Kosova

Chim.Tech.Acta, 2022, 9
DOI: 10.15826/chimtech.2022.9.3.10

Fluorinated Rocksalt Cathode with Ultra‐high Active Li Content for Lithium‐ion Batteries

Yi Pei, Qing Chen, Yang Ha, Dong Su, Hua Zhou, Shuang Li, Zhenpeng Yao, Lu Ma, Kevin J. Sanders, Chuanchao Sheng, Gillian R. Goward, Lin Gu, Aiping Yu, Wanli Yang and Zhongwei Chen

Angewandte Chemie, 2022, 134
DOI: 10.1002/ange.202212471

Effect of Cation Disorder on Lithium Transport in Halide Superionic Conductors

Peichen Zhong, Sunny Gupta, Bowen Deng, KyuJung Jun and Gerbrand Ceder

ACS Energy Lett., 2024, 9, 2775
DOI: 10.1021/acsenergylett.4c00799

Revealing Redox Pathways and Structural Evolution in Cation-Disordered Li2MnO2F via Operando X-ray Absorption Spectroscopy

Mathieu Cogniard, Yohan Biecher, Davide Salusso, Adrien Boulineau and Jean-François Colin

Chem. Mater., 2025, 37, 5581
DOI: 10.1021/acs.chemmater.5c00640

Rechargeable Alkali-Ion Battery Materials: Theory and Computation

Anton Van der Ven, Zhi Deng, Swastika Banerjee and Shyue Ping Ong

Chem. Rev., 2020, 120, 6977
DOI: 10.1021/acs.chemrev.9b00601

Toward high-energy Mn-based disordered-rocksalt Li-ion cathodes

Hao Li, Richie Fong, Moohyun Woo, Hoda Ahmed, Dong-Hwa Seo, Rahul Malik and Jinhyuk Lee

Joule, 2022, 6, 53
DOI: 10.1016/j.joule.2021.11.005

Increasing Capacity in Disordered Rocksalt Cathodes by Mg Doping

Peichen Zhong, Zijian Cai, Yaqian Zhang, Raynald Giovine, Bin Ouyang, Guobo Zeng, Yu Chen, Raphaële Clément, Zhengyan Lun and Gerbrand Ceder

Chem. Mater., 2020, 32, 10728
DOI: 10.1021/acs.chemmater.0c04109

Computational Design of Cation-Disordered Li3Ta2O5 with Fast Ion Diffusion Dynamics and Rich Redox Chemistry for a High-Rate Li-Ion Battery Anode Material

Mohammed M. Obeid, Jiahui Liu, Yiheng Shen and Qiang Sun

Chem. Mater., 2023, 35, 3256
DOI: 10.1021/acs.chemmater.3c00198

Fundamental understanding and practical challenges of lithium-rich oxide cathode materials: Layered and disordered-rocksalt structure

Yameng Fan, Wenchao Zhang, Yunlong Zhao, Zaiping Guo and Qiong Cai

Energy Storage Materials, 2021, 40, 51
DOI: 10.1016/j.ensm.2021.05.005

Anion Reactivity in Cation‐Disordered Rocksalt Cathode Materials: The Influence of Fluorine Substitution

Matthew J. Crafton, Yuan Yue, Tzu‐Yang Huang, Wei Tong and Bryan D. McCloskey

Advanced Energy Materials, 2020, 10
DOI: 10.1002/aenm.202001500

Li2NiO2F a New Oxyfluoride Disordered Rocksalt Cathode Material

Xiaoyu Xu, Liquan Pi, John-Joseph Marie, Gregory J. Rees, Chen Gong, Shengda Pu, Robert A. House, Alexander W. Robertson and Peter G. Bruce

J. Electrochem. Soc., 2021, 168, 080521
DOI: 10.1149/1945-7111/ac1be1

Chemical heterogeneity for battery materials

Chenglong Zhao, Xia Zhang, Zhou Jin, Zhenpeng Yao, Marnix Wagemaker, Hong Li, Baohua Li, Xuejie Huang and Qidi Wang

Nat Rev Chem, 2026, 10, 395
DOI: 10.1038/s41570-026-00821-y

Unveiling the role of high-energy ball milling in activating reversible anionic redox and boosting Li+ kinetics of Li1.2Nb0.2Mn0.6O2 disordered rocksalt positive electrodes

Keqiang Yang, Linhui Li, Yaoyin Liu, Yanjia Zhang, Huangkai Zhou and Xiaoyuan Zeng

Ceramics International, 2026
DOI: 10.1016/j.ceramint.2026.06.159

Computationally Guided Synthesis of Battery Materials

Nathan J. Szymanski and Christopher J. Bartel

ACS Energy Lett., 2024, 9, 2902
DOI: 10.1021/acsenergylett.4c00821

Screening Na-Excess Cation-Disordered Rocksalt Cathodes with High Performance

Zichang Zhang, Jiahui Liu, Peng-Hu Du, Dingguo Xia and Qiang Sun

ACS Nano, 2024, 18, 30584
DOI: 10.1021/acsnano.4c09285

Towards commercialization of fluorinated cation-disordered rock-salt Li-ion cathodes

Gi-Hyeok Lee, Jungwoo Lim, Jeongyim Shin, Laurence J. Hardwick and Wanli Yang

Front. Chem., 2023, 11
DOI: 10.3389/fchem.2023.1098460

Design optimization of spinel-rocksalt intergrown high entropy oxide structure for enhanced electrochemical properties

Hengming Yang, Linxin He, Zhaoming Yang, Qingchun Chen, Guoquan Jiang, Junchao Zhu, Rui Xue, Nan Qiu and Yuan Wang

Journal of Alloys and Compounds, 2023, 968, 172135
DOI: 10.1016/j.jallcom.2023.172135

CLEASE: a versatile and user-friendly implementation of cluster expansion method

Jin Hyun Chang, David Kleiven, Marko Melander, Jaakko Akola, Juan Maria Garcia-Lastra and Tejs Vegge

J. Phys.: Condens. Matter, 2019, 31, 325901
DOI: 10.1088/1361-648X/ab1bbc

Regulating the Anion Redox and Suppressing the Structural Distortion of Cation-Disordered Rock-Salt Cathode Materials to Improve Cycling Durability through Chlorine Substitution

Weijian Tang, Guojun Zhou, Chengzhi Hu, Afei Li, Zhangxian Chen, Zeheng Yang, Jianhui Su and Weixin Zhang

ACS Appl. Mater. Interfaces, 2023, 15, 17938
DOI: 10.1021/acsami.3c01280

Cation disordered rocksalt anodes with three-dimensional ion transport property for high-performance lithium/sodium-ion batteries

Haoyuan Xue, Jing Gao, Xiaoyu Zhang, Zhonghao Shi, Junze Lu, Yuanchang Shi, Zhiwei Zhang, Chengxiang Wang, Longwei Yin and Rutao Wang

Energy Storage Materials, 2026, 88, 105096
DOI: 10.1016/j.ensm.2026.105096

Impact of the energy landscape on the ionic transport of disordered rocksalt cathodes

Shashwat Anand, Bin Ouyang, Tina Chen and Gerbrand Ceder

Phys. Rev. Materials, 2023, 7
DOI: 10.1103/PhysRevMaterials.7.095801