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- W3152943670 abstract "Abstract Si-based materials have been intensively investigated as anode materials for Li-ion batteries. However, the structural evolution of the materials during the lithiation reaction is still unrevealed. In this paper, the structural parameters and mechanical properties of Si, SiO x (0 < x < 2) and SiO 2 during the lithiation reaction are studied by first-principle calculation based on density functional theory. The relationship between the Li number and expansion coefficient, elastic constant, modulus, and Poisson’s ratio is systematically calculated." @default.
- W3152943670 created "2021-04-26" @default.
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- W3152943670 date "2021-05-12" @default.
- W3152943670 modified "2023-09-26" @default.
- W3152943670 title "Structural evolution of Si-based anode materials during the lithiation reaction" @default.
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- W3152943670 doi "https://doi.org/10.1088/1361-6528/abfa54" @default.
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