Theoretical insights into the catalytic mechanisms of LiNi <sub>1/3</sub> Co <sub>1/3</sub> Mn <sub>1/3</sub> O <sub>2</sub> cathode surfaces in diverse ethylene carbonate decomposition reactions
This work systematically reveals the catalytic mechanisms of LiNi 1/3 Co 1/3 Mn 1/3 O 2 cathode surfaces in EC decomposition reactions through comprehensive first-principles calculations.
Authors
- Mingyu Su
- Yi Jin (ORCID: https://orcid.org/0000-0001-6203-1281)
- Dianxue Cao (ORCID: https://orcid.org/0000-0003-2197-3859)
- Kai Zhu (ORCID: https://orcid.org/0000-0003-0908-3909)
- Yixue Wu (ORCID: https://orcid.org/0000-0003-4973-0250)
- Fanghua Ning (ORCID: https://orcid.org/0000-0001-6590-958X)
- Dan T-c Wu (ORCID: https://orcid.org/0000-0001-9669-2600)
- Huiying Zhang (ORCID: https://orcid.org/0000-0003-4250-5499)
- Yiming Guo (ORCID: https://orcid.org/0009-0007-8701-9239)
Institutions
- Shanghai University (CN)
- Harbin Engineering University (CN)
Publication Details
- Journal
- Journal of Materials Chemistry A
- Published
- 2025-11-10
- DOI
- https://doi.org/10.1039/d5ta03903g
- Primary Topic
- Advancements in Battery Materials
- Type
- article
- Field-Weighted Citation Impact
- 0.00