Degen, F., Winter, M., Bendig, D. & Tübke, J. Energy consumption of current and future production of lithium-ion and post lithium-ion battery cells. Nat. Energy 8, 1284–1295 (2023).
Weng, A. et al. Predicting the impact of formation protocols on battery lifetime immediately after manufacturing. Joule 5, 2971–2992 (2021).
Schomburg, F. et al. Lithium-ion battery cell formation: status and future directions towards a knowledge-based process design. Energy Environ. Sci. 17, 2686–2733 (2024).
Duffner, F. et al. Post-lithium-ion battery cell production and its compatibility with lithium-ion cell production infrastructure. Nat. Energy 6, 123–134 (2021).
Lin, D., Liu, Y. & Cui, Y. Reviving the lithium metal anode for high-energy batteries. Nat. Nanotechnol. 12, 194–206 (2017).
Cui, X. et al. Data-driven analysis of battery formation reveals the role of electrode utilization in extending cycle life. Joule 8, 3072–3087 (2024).
Manthiram, A. A reflection on lithium-ion battery cathode chemistry. Nat. Commun. 11, 1550 (2020).
Larcher, D. & Tarascon, J. M. Towards greener and more sustainable batteries for electrical energy storage. Nat. Chem. 7, 19–29 (2015).
He, W. et al. Challenges and recent advances in high capacity Li-rich cathode materials for high energy density lithium-ion batteries. Adv. Mater. 33, e2005937 (2021).
Assat, G. & Tarascon, J.-M. Fundamental understanding and practical challenges of anionic redox activity in Li-ion batteries. Nat. Energy 3, 373–386 (2018).
Kim, B. et al. A theoretical framework for oxygen redox chemistry for sustainable batteries. Nat. Sustain. 5, 708–716 (2022).
Liu, T. et al. Origin of structural degradation in Li-rich layered oxide cathode. Nature 606, 305–312 (2022).
Huang, W. et al. Unrecoverable lattice rotation governs structural degradation of single-crystalline cathodes. Science 384, 912–919 (2024).
Song, J. H. et al. Slab gliding, a hidden factor that induces irreversibility and redox asymmetry of lithium-rich layered oxide cathodes. Nat. Commun. 14, 4149 (2023).
Eum, D. et al. Electrochemomechanical failure in layered oxide cathodes caused by rotational stacking faults. Nat. Mater. 23, 1093–1099 (2024).
Hong, J. et al. Metal-oxygen decoordination stabilizes anion redox in Li-rich oxides. Nat. Mater. 18, 256–265 (2019).
Csernica, P. M. et al. Persistent and partially mobile oxygen vacancies in Li-rich layered oxides. Nat. Energy 6, 642–652 (2021).
Singer, A. et al. Nucleation of dislocations and their dynamics in layered oxide cathode materials during battery charging. Nat. Energy 3, 641–647 (2018).
Marie, J.-J. et al. Trapped O2 and the origin of voltage fade in layered Li-rich cathodes. Nat. Mater. 23, 818–825 (2024).
Liu, Z. et al. Revealing the degradation pathways of layered Li-rich oxide cathodes. Nat. Nanotechnol. 19, 1821–1830 (2024).
Jang, H. Y. et al. Structurally robust lithium-rich layered oxides for high-energy and long-lasting cathodes. Nat. Commun. 15, 1288 (2024).
Wu, T. et al. Full concentration gradient‐tailored Li‐rich layered oxides for high‐energy lithium‐ion batteries. Adv. Mater. 33, 2001358 (2020).
Luo, D. et al. A Li-rich layered oxide cathode with negligible voltage decay. Nat. Energy 8, 1078–1087 (2023).
Yoon, M. et al. Eutectic salt-assisted planetary centrifugal deagglomeration for single-crystalline cathode synthesis. Nat. Energy 8, 482–491 (2023).
Zhang, J. et al. Addressing voltage decay in Li-rich cathodes by broadening the gap between metallic and anionic bands. Nat. Commun. 12, 3071 (2021).
Qiu, B. et al. Gas-solid interfacial modification of oxygen activity in layered oxide cathodes for lithium-ion batteries. Nat. Commun. 7, 12108 (2016).
Zhu, Z. et al. Gradient Li-rich oxide cathode particles immunized against oxygen release by a molten salt treatment. Nat. Energy 4, 1049–1058 (2019).
Li, Q. et al. Improving the oxygen redox reversibility of Li-rich battery cathode materials via Coulombic repulsive interactions strategy. Nat. Commun. 13, 1123 (2022).
Xu, G.-L. et al. Building ultraconformal protective layers on both secondary and primary particles of layered lithium transition metal oxide cathodes. Nat. Energy 4, 484–494 (2019).
Hu, E. et al. Evolution of redox couples in Li- and Mn-rich cathode materials and mitigation of voltage fade by reducing oxygen release. Nat. Energy 3, 690–698 (2018).
Wang, Q. et al. Chemical short-range disorder in lithium oxide cathodes. Nature 629, 341–347 (2024).
Yin, W. et al. Structural evolution at the oxidative and reductive limits in the first electrochemical cycle of Li1.2Ni0.13Mn0.54Co0.13O2. Nat. Commun. 11, 1252 (2020).
Li, B. et al. Capturing dynamic ligand-to-metal charge transfer with a long-lived cationic intermediate for anionic redox. Nat. Mater. 21, 1165–1174 (2022).
Wang, C. et al. Resolving complex intralayer transition motifs in high-Ni-content layered cathode materials for lithium-ion batteries. Nat. Mater. 22, 235–241 (2023).
Li, B. et al. Decoupling the roles of Ni and Co in anionic redox activity of Li-rich NMC cathodes. Nat. Mater. 22, 1370–1379 (2023).
Li, B. et al. Correlating ligand-to-metal charge transfer with voltage hysteresis in a Li-rich rock-salt compound exhibiting anionic redox. Nat. Chem. 13, 1070–1080 (2021).
Li, J. et al. Dynamics of particle network in composite battery cathodes. Science 376, 517–521 (2022).
Xue, Z. et al. Asynchronous domain dynamics and equilibration in layered oxide battery cathode. Nat. Commun. 14, 8394 (2023).
Qiu, B. et al. Metastability and reversibility of anionic redox-based cathode for high-energy rechargeable batteries. Cell Rep. Phys. Sci. 1, 100028 (2020).
Xu, C. et al. Bulk fatigue induced by surface reconstruction in layered Ni-rich cathodes for Li-ion batteries. Nat. Mater. 20, 84–92 (2021).
Kresse, G. & Furthmüller, J. Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set. Phys. Rev. B 54, 11169–11186 (1996).
Kresse, G. & Joubert, D. From ultrasoft pseudopotentials to the projector augmented-wave method. Phys. Rev. B 59, 1758–1775 (1999).
Wang, G. et al. ALKEMIE: an intelligent computational platform for accelerating materials discovery and design. Comput. Mater. Sci. 186, 110064 (2021).
Liu, P. et al. Lithium deficiencies engineering in Li-rich layered oxide Li1.098Mn0.533Ni0.113Co0.138O2 for high-stability cathode. J. Am. Chem. Soc. 141, 10876–10882 (2019).

