1. Impact of Transition Metal Layer Vacancy on the Structure and Performance of P2 Type Layered Sodium Cathode Material.
- Author
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Zhanadilov, Orynbay, Baiju, Sourav, Voronina, Natalia, Yu, Jun Ho, Kim, A-Yeon, Jung, Hun-Gi, Ihm, Kyuwook, Guillon, Olivier, Kaghazchi, Payam, and Myung, Seung-Taek
- Subjects
TRANSITION metals ,TRANSMISSION electron microscopy ,X-ray absorption ,STRUCTURAL stability ,OXIDATION states - Abstract
Highlights: Vacancy in the transition metal layer of sodium cathode material induces the formation lone-pair electrons in the O 2p orbital. Material delivers more capacity from the oxygen redox validated by density functional calculation. Widened dominance of the OP4 phase without releasing O
2 gas. This study explores the impact of introducing vacancy in the transition metal layer of rationally designed Na0.6 [Ni0.3 Ru0.3 Mn0.4 ]O2 (NRM) cathode material. The incorporation of Ru, Ni, and vacancy enhances the structural stability during extensive cycling, increases the operation voltage, and induces a capacity increase while also activating oxygen redox, respectively, in Na0.7 [Ni0.2 VNi0.1 Ru0.3 Mn0.4 ]O2 (V-NRM) compound. Various analytical techniques including transmission electron microscopy, X-ray absorption near edge spectroscopy, operando X-ray diffraction, and operando differential electrochemical mass spectrometry are employed to assess changes in the average oxidation states and structural distortions. The results demonstrate that V-NRM exhibits higher capacity than NRM and maintains a moderate capacity retention of 81% after 100 cycles. Furthermore, the formation of additional lone-pair electrons in the O 2p orbital enables V-NRM to utilize more capacity from the oxygen redox validated by density functional calculation, leading to a widened dominance of the OP4 phase without releasing O2 gas. These findings offer valuable insights for the design of advanced high-capacity cathode materials with improved performance and sustainability in sodium-ion batteries. [ABSTRACT FROM AUTHOR]- Published
- 2024
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