33 citations · 61 across the 5 of their papers we have counts for
5 papers
Water Flow Through Polar and Non-Polar Nanopores: Insights from Multiscale Simulations
Elizane E. de Moraes, João Victor Lemos Valle, Bruno H. S. Mendonça +3
Global water stress has emerged as a critical challenge, driving the search for advanced membrane materials that enable efficient, selective water filtration and transport. In this…
Enhanced diffusion in self-nanoconfined water channels between periodically modulated surfaces: insights from molecular dynamics simulations
Bruno H. S. Mendonça, Elizane E. de Moraes, Hélio Chacham
Water nanoconfinement is known to occur inside material void spaces, such as 2D confinement between surfaces, 1D confinement inside nanotubes, and variable-dimension confinement in…
Wetting in Associating Lattice Gas Model Confined by Hydrophilic Walls
Tássylla O. Fonseca, Bruno H. S. Mendonça, Elizane E. de Moraes +2
Through Monte Carlo simulations and the Associating Lattice Gas Model, the phases of a two-dimensional fluid under hydrophilic confinement are evaluated. The model, in its unconfin…
Water diffusion in carbon nanotubes under directional electric fields: Coupling between mobility and hydrogen bonding
Débora N. de Freitas, Bruno H. S. Mendonça, Mateus H. Köhler +4
We have investigated the diffusion and structure of TIP4P/2005 water confined in carbon nanotubes subjected to external electric fields. A wide range of diameters has been used to…
Diffusion behavior of water confined in deformed carbon nanotubes
Bruno H. S. Mendonça, Débora N. de Freitas, Mateus H. Köhler +3
We use molecular dynamics simulations to study the diffusion of water inside deformed carbon nanotubes, with different degrees of eccentricity at 300K. We found a water structural…