First-Principles Studies of the Lithiation and Delithiation Paths in Si Anodes in Li-Ion Batteries

Engineering & Materials Science

• Amorphization 99%
• Lithium-ion batteries 97%
• Anodes 87%
• Crystalline materials 63%
• Tensile stress 60%
• Lithium batteries 41%
• Silicides 41%
• Molecular dynamics 34%
• Lithium 33%
• Phase transitions 31%
• Atoms 31%
• Ions 27%
• Silicon 23%
• Networks (circuits) 16%
• Electric potential 15%

Physics & Astronomy

• electric batteries 93%
• anodes 77%
• tensile stress 62%
• lithium batteries 43%
• ions 42%
• ledges 41%
• hydrostatics 32%
• energy of formation 31%
• silicides 31%
• lithium 26%
• phase transformations 26%
• flux density 24%
• molecular dynamics 21%
• causes 18%
• energy 17%
• electric potential 16%
• silicon 16%
• atoms 15%

Chemical Compounds

• Lithiation 100%
• Anode 66%
• Amorphization 45%
• Energy 25%
• Amorphous Material 25%
• Volume 20%
• Open Circuit Potential 20%
• Molecular Dynamics 13%
• Voltage 13%
• Crystal Structure 9%