Molecular-level insights into interfacial interaction–nanostructure relationships of imidazolium-based ionic liquids around carbon nanotube electrodes

K Peng, J Lin, D Yang, F Fu, Z Dai… - Industrial & …, 2022 - ACS Publications
Here, we performed classical molecular dynamics simulations to systematically explore the
relationships between interfacial interactions and nanostructures of an imidazolium-based …

Ionanofluids based on ionic liquid mixtures, a new approach as an alternative material for solar energy storage

J Cavieres, MJ Inestrosa-Izurieta, DA Vasco… - Journal of Molecular …, 2022 - Elsevier
Hybrid materials based on ionic liquids (ILs) known as Ionanofluids (INFs) have shown
exciting improvements in their thermophysical properties compared to their base fluids (BF) …

Interaction of an imidazolium based ionic liquid with antidepressant drugs: A physicochemical study

LKS Tanwar, S Sharma, KK Ghosh - Colloids and Surfaces A …, 2022 - Elsevier
The effect of two antidepressant drugs ie, CPZ and PMZ on the colloidal behaviour of 1-
decyl-3-methyl-imidazolium tetrafluoroborate [Dmim][BF 4] ionic liquid has been studied and …

Molecular dynamics simulations of structures, dynamics, competitive interaction mechanisms for CH4, CO2, and SO2 in ionic liquid mixtures of [Cnmim][Nf2T] and …

R He, K Peng, Q Wu, L Li, X Wang, G Zhou, Z Yang - Fluid Phase Equilibria, 2022 - Elsevier
Here, we performed a series of molecular dynamics (MD) simulations to investigate the
structures, dynamics, and competitive interaction mechanisms of CH 4, CO 2, and SO 2 in …

Molecular-Level Understanding of Surface Roughness Boosting Segregation Behavior at the ZIF-8/Ionic Liquid Interfaces

L Li, J Lin, F Fu, Z Dai, G Zhou, Z Yang - Langmuir, 2022 - ACS Publications
Here, we perform a series of classical molecular dynamics simulations for two different
[HEMIM][DCA] and [BMIM][BF4] ionic liquids (ILs) on the ZIF-8 surface to explore the …