Modeling and Simulation of Concentrated Aqueous Solutions of LiTFSI for Battery Applications

Physics & Astronomy

• anions 23%
• aqueous solutions 90%
• charge transfer 21%
• conduction 16%
• diffusivity 22%
• electric batteries 100%
• electrolytes 20%
• electronics 12%
• field theory (physics) 24%
• hydrogen bonds 50%
• ions 34%
• lithium 21%
• molecular dynamics 17%
• molecules 26%
• oxygen 14%
• oxygen atoms 25%
• polarization 13%
• predictions 13%
• scaling 17%
• simulation 37%
• solvation 26%
• water 55%

Engineering & Materials Science

• Atoms 25%
• Charge transfer 31%
• Computer simulation 13%
• Electrolytes 23%
• Hydrogen bonds 67%
• Ions 67%
• Lithium 27%
• Molecular dynamics 27%
• Molecular mechanics 39%
• Molecules 47%
• Negative ions 33%
• Oxygen 39%
• Polarization 22%
• Solvation 39%
• Water 53%

Chemical Compounds

• Anion 19%
• Application 30%
• Aqueous Solution 50%
• Charge Transfer 22%
• Dioxygen 15%
• Force 22%
• Hydrogen Bond 39%
• Ion 38%
• Molecular Dynamics 24%
• Molecular Mechanic 32%
• Molecule 22%
• Oxygen Atom 26%
• Polarization 24%
• Simulation 61%
• Solvation 27%