ReaxFF reactive force field simulations on the influence of teflon on electrolyte decomposition during li/swcnt anode discharge in lithium-sulfur batteries

Physics & Astronomy

• lithium sulfur batteries 100%
• teflon (trademark) 66%
• field theory (physics) 57%
• anodes 48%
• electrolytes 46%
• lithium 43%
• decomposition 42%
• simulation 21%
• reactivity 21%
• ethylene 13%
• countermeasures 9%
• commercialization 9%
• electrodes 8%
• reaction products 7%
• ethers 7%
• energy storage 7%
• heat transmission 7%
• glycols 7%
• dendrites 7%
• surface treatment 7%
• electric batteries 7%
• safety 6%
• reaction kinetics 6%
• carbon nanotubes 6%
• chemistry 6%
• dissociation 5%
• degradation 5%
• molecular dynamics 5%
• coatings 4%
• composite materials 4%
• causes 4%
• gases 3%
• metals 3%
• performance 3%

Engineering & Materials Science

• Lithium sulfur batteries 95%
• Polytetrafluoroethylenes 64%
• Electrolytes 54%
• Lithium 54%
• Anodes 54%
• Decomposition 40%
• Electrodes 10%
• Reaction products 9%
• Surface chemistry 9%
• Ethylene glycol 9%
• Dendrites (metallography) 8%
• Ethers 8%
• Molecular dynamics 7%
• Reaction kinetics 7%
• Carbon nanotubes 7%
• Surface treatment 7%
• Ethylene 7%
• Energy storage 6%
• Coatings 5%
• Degradation 4%
• Heat transfer 4%
• Metals 4%
• Composite materials 4%
• Gases 4%
• Computer simulation 3%

Chemical Compounds

• Poly(tetrafluoroethylene) 58%
• Anode 41%
• Force 38%
• Decomposition 36%
• Simulation 35%
• Tetraethylene Glycol 10%
• Dimethyl Ether 9%
• Heat Transfer 8%
• Behavior as Electrode 8%
• Single Walled Nanotube 7%
• Surface Chemistry 7%
• Safety 6%
• Energy Storage 6%
• Coating Agent 4%
• Environment 4%
• Gas 4%
• Composite Material 4%
• Metal 3%
• Reaction Yield 3%
• Surface 2%
• Application 2%