173 citations · 506 across the 5 of their papers we have counts for
5 papers
Water diffusion in carbon nanotubes: interplay between confinement, surface deformation and temperature
Bruno H. S. Mendonça, Patricia Ternes, Evy Salcedo +2
In this article we investigate through molecular dynamics simulations the diffusion behavior of the TIP4P/2005 water when confined in pristine and deformed carbon nanotubes (armcha…
Water diffusion in rough carbon nanotubes
Bruno H. S. Mendonça, Patricia Ternes, Evy Salcedo +2
We use molecular dynamics simulations to study the diffusion of water inside deformed carbon nanotubes with different degrees of deformation at 300 K. We found that the number of h…
Water-like hierarchy of anomalies in a continuous spherical shouldered potential
Alan Barros de Oliveira, Giancarlo Franzese, Paulo A. Netz +1
We investigate by molecular dynamics simulations a continuous isotropic core-softened potential with attractive well in three dimensions, introduced by Franzese [cond-mat/0703681,…
Structural anomalies for a three dimensional isotropic core-softened potential
Alan B. de Oliveira, Paulo A. Netz, Thiago Colla +1
Using molecular dynamics simulations we investigate the structure of a system of particles interacting through a continuous core-softened interparticle potential. We found for the…
Thermodynamic and dynamic anomalies for a three dimensional isotropic core-softened potential
Alan B. de Oliveira, Paulo A. Netz, Thiago Colla +1
Using molecular dynamics simulations and integral equations (Rogers-Young, Percus-Yevick and hypernetted chain closures) we investigate the thermodynamic of particles interacting w…