Classical & AIMD simulations of organic solvent-based high conc. Na-salt electrolytes (HCEs) reveal 1) Na ions can pair up, solvated by anions & solvent molecules 2) doping Li enhances electrical conductivity @SrimayeeMukher@DishaBrahma1997@jncbala
https://t.co/WuBk4IUvrc
Work of @DishaBrahma1997 & @nimishdwar appeared in @ChemMater "CNR Rao at 90" Special Issue!
Predicting the Inflection Point in water adsorption isotherms in COFs for Atmospheric Water Harvest using NVT+W Monte Carlo Simulations
https://t.co/JNrFjBpx8J