18 citations · 36 across the 7 of their papers we have counts for
4 papers · 1 filter
Mechanical and adsorption properties of greenhouse gases filled carbon nanotubes
Daniela Andrade Damasceno, Henrique Musseli Cezar, Teresa Duarte Lanna +2
We investigate the mechanical and adsorption properties of single-walled carbon nanotubes (SWCNTs) filled with greenhouse gases through Grand Canonical Monte Carlo (GCMC) and Molec…
Effects of van der Waals interaction on the N adsorption on carbon nanotubes: proposal of new force field parameters
Carlos Alberto Martins Junior, Henrique Musseli Cezar, Daniela Andrade Damasceno +1
The separation of carbon dioxide CO from nitrogen gas (N), the main component of flue gas, has become an emerging action to mitigate climate change. Feasible and efficient…
Water adsorption in ultrathin silica nanotubes
Henrique Musseli Cezar, Caetano Rodrigues Miranda
Silica (SiO) nanotubes (NTs) are used in a wide range of applications that go from sensors to nanofluidics. Currently, these NTs can be grown with diameters as small as 3 nm, w…
Revisiting greenhouse gases adsorption in carbon nanostructures: advances through a combined first-principles and molecular simulation approach
Henrique Musseli Cezar, Teresa Duarte Lanna, Daniela Andrade Damasceno +2
Carbon nanostructures are promising materials to improve the performance of current gas separation membrane technologies. From the molecular modeling perspective, an accurate descr…