学科分类
/ 1
1个结果
  • 简介:Lithiation-inducedplasticityisakeyfactorthatenablesSielectrodestomaintainlongcyclelifeinLi-ionbatteries.Westudytheplasticityofvariouslithiatedsili-conphasesbasedonfirst-principlescalculationsandiden-tifythelineardependenceoftheequivalentyieldstressonthehydrostaticpressure.Suchdependencemaycausethecompression-tensionasymmetryinanamorphousSithinfilmelectrodefromalithiationtodelithiationcycle,andleadstosubsequentratchetingoftheelectrodeaftercycliclithiation.Weproposeayieldcriterionofamorphouslithi-atedsiliconthatincludestheeffectsofthehydrostaticstressandthelithiationreaction.Wefurtherexaminethemicro-scopicmechanismofdeformationinlithiatedsiliconundermechanicalload,whichisattributedtotheflow-defectsmediatedlocalbondswitchingandcavitation.Hydrostaticcompressionconfinestheflowdefectsthuseffectivelystrength-enstheamorphousstructure,andviceversa.

  • 标签:锂离子电池可塑性硅相压力敏感第一性原理计算锂化反应
Baidu
map