Lithiation Mechanism of Methylated Amorphous Silicon Unveiled by Operando ATR-FTIR Spectroscopy

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Abstract

The lithiation mechanism of methylated amorphous silicon, a-Si1−x(CH3)x:H, with various methyl contents (x = 0 - 0.12) is investigated using operando attenuated total reflection Fourier transform infrared spectroscopy. As in hydrogenated amorphous silicon, a-Si:H, the first lithiation proceeds via a two-phase mechanism. The concentration of the invading Li-rich phase nonmonotonously depends on the methyl content of the active material. This behavior is tentatively explained by two distinct effects: a softening of the material due to a methyl-induced lowering of its reticulation degree and its cohesion, and the presence of nanovoids at high enough methyl content.

Original languageEnglish
Article number1702568
JournalAdvanced Energy Materials
Volume8
Issue number13
DOIs
Publication statusPublished - 4 May 2018
Externally publishedYes

Keywords

  • Li-ion batteries
  • amorphous silicon
  • lithiation mechanisms
  • operando ATR-FTIR
  • silicon anodes

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