The advent of solid‐state polymer electrolytes for application in lithium batteries took place
more than four decades ago when the ability of polyethylene oxide (PEO) to dissolve …

Combined experimental and computational studies of lipid membranes and liposomes, with
the aim to attain mechanistic understanding, result in a synergy that makes possible the …

Theoretical investigations of ionic liquids are reviewed. Three main cate-gories are
discussed, ie, static quantum chemical calculations (electronic structure methods), traditional …

Based on classical molecular dynamics simulations, we discuss the impact of Coulombic
interactions on a comprehensive set of properties of room temperature ionic liquids (RTILs) …

Molecular dynamics simulations are used to study the dynamics and transport properties of
12 room-temperature ionic liquids of the 1-alkyl-3-methylimidazolium [amim]+(⁠ alkyl …

Understanding the mechanisms and optimizing ion transport in polymer membranes have
been the subject of active research for more than three decades. We present an overview of …

Increasing the ionic conductivity has for decades been an overriding goal in the
development of solid polymer electrolytes. According to fundamental theories on ion …

This paper presents atomistic molecular dynamics simulation studies of lithium bis
(trifluoromethane) sulfonylimide (LiTFSI) in a blend of 1-ethyl-3-methylimidazolium (EMIm) …

Understanding how microscopic mechanisms govern macroscopic transport properties is
important for development of improved electrolytes for Li-ion batteries. The archetypal …

In recent years, the global climate change is in evidence and it is almost a consensus that it
is caused by the greenhouse gases emissions. An alternative to reduce these emissions is …