Microstructure dependent chemo-mechanical behavior of amorphous Si anodes for Li-ion batteries upon delithiation

M Wang, H Ye - Journal of Power Sources, 2022 - Elsevier
Alloying-type anodes exhibit the solid-state amorphization during charging/discharging
cycles. The mechanical and electrochemical properties of amorphous reaction phases have …

Intrinsic stress mitigation via elastic softening during two-step electrochemical lithiation of amorphous silicon

Z Jia, T Li - Journal of the Mechanics and Physics of Solids, 2016 - Elsevier
Recent experiments and first-principles calculations show the two-step lithiation of
amorphous silicon (a-Si). In the first step, the lithiation progresses by the movement of a …

Predicting buckling regimes during first lithiation of a crystalline silicon cylindrical anode particle: Influence of size and charging rate

A Bhowmick, J Chakraborty - Mechanics of Materials, 2024 - Elsevier
A mathematical model for buckling analysis during the first lithiation of cylindrical crystalline
silicon (c-Si) anode particles is presented using the finite deformation framework. A reaction …

Quantifying electrochemical reactions and properties of amorphous silicon in a conventional lithium-ion battery configuration

X Wang, SS Singh, T Ma, C Lv, N Chawla… - Chemistry of …, 2017 - ACS Publications
Despite many existing studies on silicon (Si) anodes for lithium ion batteries (LIBs), many
essential questions still exist on compound formation, composition, and properties. Here we …

Path independent integrals in equilibrium electro-chemo-elasticity

M Zhang, J Qu, JR Rice - Journal of the Mechanics and Physics of Solids, 2017 - Elsevier
By using the Noether's first theorem, this paper constructed two types of path-independent
integrals in equilibrium electro-chemo-elasticity and proved their uniqueness. These path …

[HTML][HTML] Improving predictions of amorphous-crystalline silicon interface velocity through alloying-dealloying reactions in lithium-ion battery anode particles

A Bhowmick, J Chakraborty - International Journal of Solids and Structures, 2021 - Elsevier
An improved mathematical model for the first lithiation of crystalline silicon is presented in
the finite deformation framework. The crystalline-amorphous silicon interface kinetics is …

[HTML][HTML] Lithium diffusion in silicon and induced structure disorder: A molecular dynamics study

H Wang, X Ji, C Chen, K Xu, L Miao - AIP Advances, 2013 - pubs.aip.org
Using molecular dynamics method, we investigate the diffusion property of lithium in
different silicon structures and silicon structure's disorder extent during lithium's diffusion …

Two-dimensional chemo-elasticity under chemical equilibrium

H Haftbaradaran, J Qu - International Journal of Solids and Structures, 2015 - Elsevier
The coupling between solid state diffusion and mechanical stress arises in a number of
important technological applications. The theory that describes such coupling is termed …

Predicting non-axisymmetric growth and facet evolution during lithiation of crystalline silicon anode particles through orientation-dependent interface reaction

A Bhowmick, J Chakraborty - International Journal of Solids and Structures, 2023 - Elsevier
A finite deformation modeling framework is developed to capture the experimentally
observed two-phase, non-axisymmetric growth during the first lithiation of crystalline silicon …

Understanding size-dependent migration of a two-phase lithiation front coupled to stress

Y Lu, AK Soh, Y Ni, L He - Acta Mechanica, 2019 - Springer
Recent in-situ experiments show that stress-driven migration of the phase interface during
two-phase lithiation in nanosized particles exhibits self-limiting and size-dependent …