Carbon nanomaterials with Thymol + Menthol Type V natural deep eutectic solvent: From surface properties to nano-Venturi effect through nanopores

A theoretical study using Density Functional Theory and classical Molecular Dynamics simulations for the of carbon nanomaterials in archetypical Menthol + Thymol Type V Natural Deep Eutectic Solvent is reported. The nanoscopic structure representative nanofluid analyzed considering confinement, adsorption solvation effects, as well consequences on diffusion properties through nano pores. Different types were considered such fullerenes, nanotubes, graphene nanopores. allowed to analyze response solvent presence nanomaterials, taking into account rearrangement confinement nanocavities surfaces. This shows liquid mobility consequences, with a sort nano-Venturi effect among them. reported results provide first time characterization this type natural solvents sustainable platform development – nanomaterials-based technologies.