Development of the ReaxFF Reactive Force Field for Li/Mn/O Battery Technology with Application to Design a Self-Healing Cathode Electrolyte Interphase

Lithium manganese oxide (LMO) batteries, notable for their three-dimensional structure enhancing ion transport and power, are ideal for critical uses, such as implantable biomedical devices, where battery life and performance are crucial for safety. Understanding their internal chemical reactions is...

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Veröffentlicht in:	Journal of physical chemistry. C 2024-04, Vol.128 (16), p.6538-6550
Hauptverfasser:	Talkhoncheh, Mahdi Khajeh, Ghods, Hamed, Doosthosseini, Mahsa, Silberberg, Jeffrey, Kyprianou, Iacovos, van Duin, Adri C. T.
Format:	Artikel
Sprache:	eng
Schlagworte:	C: Energy Conversion and Storage
Online-Zugang:	Volltext
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