研究成果

2025

• He, J., Yu, R., Liu, F., Zhang, Y., Jin, C., Zhang, B., Cai, Z., and Lun, Z. (2025). Minimizing the Reaction Heterogeneity in Ultrafast Joule Heating Synthesis of Disordered Rocksalt Cathodes. Chemistry of Materials.
• Kim, H., Jun, K., Szymanski, N., Sai Avvaru, V., Cai, Z., Crafton, M., Lee, G.H., Trask, S.E., Babbe, F., and Byeon, Y.W. (2025). Screening and Development of Sacrificial Cathode Additives for Lithium‐Ion Batteries. Advanced Energy Materials 15, 2403946. PDF
• Moździerz, M., Holstun, T., Cai, Z., Lee, G.H., Hau, H.M., Yang, X., Chen, Y., Czaja, P., Yang, W., and Świerczek, K. (2025). Tuning Cation (Dis) Order in Cr‐Based Li‐Excess Oxide Cathode Materials to Improve Li+ Transport Properties. Advanced Energy Materials, 2502157. PDF

2024

• Yang, X., Gupta, S., Chen, Y., Sari, D., Hau, H.M., Cai, Z., Dun, C., Qi, M., Ma, L., and Liu, Y. (2024). Fast Room‐Temperature Mg‐Ion Conduction in Clay‐Like Halide Glassy Electrolytes. Advanced Energy Materials 14, 2400163. PDF
• Hau, H.-M., Mishra, T., Ophus, C., Huang, T.-Y., Bustilo, K., Sun, Y., Yang, X., Holstun, T., Zhao, X., and Wang, S. (2024). Earth-abundant Li-ion cathode materials with nanoengineered microstructures. Nature Nanotechnology 19, 1831–1839. PDF
• Huang, T.-Y., Cai, Z., Crafton, M.J., Giovine, R., Patterson, A., Hau, H.-M., Rastinejad, J., Rinkel, B.L., Clément, R.J., and Ceder, G. (2024). Chemical origin of in situ carbon dioxide outgassing from a cation-disordered rock salt cathode. Chemistry of Materials 36, 6535–6546. PDF
• Chen, Y., Lun, Z., Zhao, X., Koirala, K.P., Li, L., Sun, Y., O’Keefe, C.A., Yang, X., Cai, Z., and Wang, C. (2024). Unlocking Li superionic conductivity in face-centred cubic oxides via face-sharing configurations. Nature Materials 23, 535–542. PDF
• Cai, Z., Ouyang, B., Hau, H.-M., Chen, T., Giovine, R., Koirala, K.P., Li, L., Ji, H., Ha, Y., and Sun, Y. (2024). In situ formed partially disordered phases as earth-abundant Mn-rich cathode materials. Nature Energy 9, 27–36. PDF

2023

• Wang, J., He, T., Yang, X., Cai, Z., Wang, Y., Lacivita, V., Kim, H., Ouyang, B., and Ceder, G. (2023). Design principles for NASICON super-ionic conductors. Nature Communications 14, 5210. PDF
• Huang, T.Y., Cai, Z., Crafton, M.J., Kaufman, L.A., Konz, Z.M., Bergstrom, H.K., Kedzie, E.A., Hao, H.M., Ceder, G., and McCloskey, B.D. (2023). Quantitative Decoupling of Oxygen‐Redox and Manganese‐Redox Voltage Hysteresis in a Cation‐Disordered Rock Salt Cathode. Advanced Energy Materials 13, 2300241. PDF
• Huang, J., Ouyang, B., Zhang, Y., Yin, L., Kwon, D.-H., Cai, Z., Lun, Z., Zeng, G., Balasubramanian, M., and Ceder, G. (2023). Inhibiting collective cation migration in Li-rich cathode materials as a strategy to mitigate voltage hysteresis. Nature Materials 22, 353–361. PDF
• Huang, L., Zhong, P., Ha, Y., Cai, Z., Byeon, Y.W., Huang, T.Y., Sun, Y., Xie, F., Hau, H.M., and Kim, H. (2023). Optimizing Li‐Excess Cation‐Disordered Rocksalt Cathode Design Through Partial Li Deficiency. Advanced Energy Materials 13, 2202345. PDF

2022

• Zeng, Y., Ouyang, B., Liu, J., Byeon, Y.-W., Cai, Z., Miara, L.J., Wang, Y., and Ceder, G. (2022). High-entropy mechanism to boost ionic conductivity. Science 378, 1320–1324. PDF
• Sun, Y., Ouyang, B., Wang, Y., Zhang, Y., Sun, S., Cai, Z., Lacivita, V., Guo, Y., and Ceder, G. (2022). Enhanced ionic conductivity and lack of paddle-wheel effect in pseudohalogen-substituted Li argyrodites. Matter 5, 4379–4395. PDF
• Zhao, X., Tian, Y., Lun, Z., Cai, Z., Chen, T., Ouyang, B., and Ceder, G. (2022). Design principles for zero-strain Li-ion cathodes. Joule 6, 1654–1671. PDF
• Szymanski, N.J., Zeng, Y., Bennett, T., Patil, S., Keum, J.K., Self, E.C., Bai, J., Cai, Z., Giovine, R., and Ouyang, B. (2022). Understanding the fluorination of disordered rocksalt cathodes through rational exploration of synthesis pathways. Chemistry of Materials 34, 7015–7028. PDF
• Cai, Z., Zhang, Y.Q., Lun, Z., Ouyang, B., Gallington, L.C., Sun, Y., Hau, H.M., Chen, Y., Scott, M.C., and Ceder, G. (2022). Thermodynamically driven synthetic optimization for cation‐disordered rock salt cathodes. Advanced Energy Materials 12, 2103923. PDF
• Wang, Z., Kononova, O., Cruse, K., He, T., Huo, H., Fei, Y., Zeng, Y., Sun, Y., Cai, Z., and Sun, W. (2022). Dataset of solution-based inorganic materials synthesis procedures extracted from the scientific literature. Scientific Data 9, 231. PDF
• Byeon, Y.-W., Mailoa, J., Kornbluth, M., Lee, G.-H., Cai, Z., Sun, Y., Yang, W., Johnston, C., Christensen, J., and Kim, S. (2022). Electronic structure manipulation via composition tuning for the development of highly conductive and acid-stable oxides. Journal of Materials Chemistry A 10, 23155–23164. PDF

2021

• Chen, Y., Bartel, C.J., Avdeev, M., Zhang, Y.-Q., Liu, J., Zhong, P., Zeng, G., Cai, Z., Kim, H., and Ji, H. (2021). Solid-state calcium-ion diffusion in Ca1.5Ba0.5Si5O3N6. Chemistry of Materials 34, 128–139. PDF
• Cai, Z., Ji, H., Ha, Y., Liu, J., Kwon, D.-H., Zhang, Y., Urban, A., Foley, E.E., Giovine, R., and Kim, H. (2021). Realizing continuous cation order-to-disorder tuning in a class of high-energy spinel-type Li-ion cathodes. Matter 4, 3897–3916. PDF
• Lun, Z., Ouyang, B., Kwon, D.-H., Ha, Y., Foley, E.E., Huang, T.-Y., Cai, Z., Kim, H., Balasubramanian, M., and Sun, Y. (2021). Cation-disordered rocksalt-type high-entropy cathodes for Li-ion batteries. Nature Materials 20, 214–221. PDF

2020

• Zhong, P., Cai, Z., Zhang, Y., Giovine, R., Ouyang, B., Zeng, G., Chen, Y., Clément, R., Lun, Z., and Ceder, G. (2020). Increasing capacity in disordered rocksalt cathodes by Mg doping. Chemistry of Materials 32, 10728–10736. PDF
• Ji, H., Wu, J., Cai, Z., Liu, J., Kwon, D.-H., Kim, H., Urban, A., Papp, J.K., Foley, E., and Tian, Y. (2020). Ultrahigh power and energy density in partially ordered lithium-ion cathode materials. Nature Energy 5, 213–221. PDF
• Lun, Z., Ouyang, B., Cai, Z., Clément, R.J., Kwon, D.-H., Huang, J., Papp, J.K., Balasubramanian, M., Tian, Y., and McCloskey, B.D. (2020). Design principles for high-capacity Mn-based cation-disordered rocksalt cathodes. Chem 6, 153–168. PDF

2019

• Ji, H., Kitchaev, D.A., Lun, Z., Kim, H., Foley, E., Kwon, D.-H., Tian, Y., Balasubramanian, M., Bianchini, M., and Cai, Z. (2019). Computational investigation and experimental realization of disordered high-capacity Li-ion cathodes based on Ni redox. Chemistry of Materials 31, 2431–2442. PDF
• Ji, H., Urban, A., Kitchaev, D.A., Kwon, D.-H., Artrith, N., Ophus, C., Huang, W., Cai, Z., Shi, T., and Kim, J.C. (2019). Hidden structural and chemical order controls lithium transport in cation-disordered oxides for rechargeable batteries. Nature Communications 10, 592. PDF

2018

• Liu, P., Cai, Z., You, Y., Huang, H., Chen, S., Gao, C., Qi, Z., Long, R., Zhu, J., and Song, L. (2018). Surface Modification on Pd‐TiO2 Hybrid Nanostructures towards Highly Efficient H2 Production from Catalytic Formic Acid Decomposition. Chemistry–A European Journal 24, 18398–18402. PDF
• You, Y., Huang, H., Xia, S., Cai, Z., Liu, P., Wang, C., Long, R., Song, L., and Xiong, Y. (2018). Design of Pd {111}-TiO2 interface for enhanced catalytic efficiency towards formic acid decomposition. Science China Chemistry 61, 1123–1127. PDF

2017

• Li, Y., Chen, S., Long, R., Ju, H., Wang, Z., Yu, X., Gao, F., Cai, Z., Wang, C., and Xu, Q. (2017). Near-surface dilution of trace Pd atoms to facilitate Pd-H bond cleavage for giant enhancement of electrocatalytic hydrogen evolution. Nano Energy 34, 306–312. PDF

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