1 citations · 1 across the 4 of their papers we have counts for
4 papers
Novel force field of [Bmim][NfT] and its tranferability in a mixture with water
Raúl Fuentes-Azcatl, Minerva González-Melchor
In this work, a new force field is presented for the ionic liquid 1-butyl-3-methylimidazolium-bis(trifluoromethylsulfonyl)imide, [Bmim][NfT]. As a part of the εforce field, the…
Water inside charged nanoslits: Structure and Dielectric study with a novel water model FAB/
Raúl Fuentes-Azcatl, José Rafael Bordin, Marcia C. Barbosa
In this work, the dielectric behavior of water inside charged nanoslit of graphene is studied to analized the water molecules under electrical confinement; through polarizing the n…
Dielectric and thermodynamic study of Carbon dioxide (CO) - methanol (CHOH) mixture
Raúl Fuentes-Azcatl, Hector Dominguez
In this paper is calculated and analyzed the dielectric behavior of carbon dioxide - methanol mixture and evaluate how the correct reproduction of the electrical properties of this…
Flexible model of water based on the dielectric and electromagnetic spectrum properties : TIP4P/ Flex
Raúl Fuentes-Azcatl
The Infrared Spectrum is used as an experimental data target, to improved the TIP4P/, adding harmonic potential U(r) in all bonds and harmonic potential U(θ) in the angle formed…