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cond-mat.soft2026
Structural and dynamical behavior of methane-water systems under nanoconfinement
José Torres-Arenas, Ángel M. Fernández-Fernández, Martín Pérez-Rodríguez +1
We investigate the structural and dynamical behavior of methane water systems under nanoconfinement using molecular dynamics simulations across pore widths from 1 to 5 nm. Structur…
cond-mat.soft2024
Simulation of the THF hydrate-water interfacial free energy from computer simulation
Miguel J. Torrejón, Cristóbal Romero-Guzmán, Manuel M. Piñeiro +2
In this work, the tetrahydrofuran (THF) hydrate-water interfacial free energy is determined at , at one point of the univariant two-phase coexistence line of the T…