Non-polarizable force field of water based on the dielectric constant: TIP4P/ε R Fuentes-Azcatl, J Alejandre
The Journal of Physical Chemistry B 118 (5), 1263-1272, 2014
159 2014 Sodium Chloride, NaCl/ϵ: New Force Field R Fuentes-Azcatl, MC Barbosa
J. Phys. Chem. B. 120 (9), 2460–2470, 2016
86 2016 Improved SPC force field of water based on the dielectric constant: SPC/ε R Fuentes-Azcatl, N Mendoza, J Alejandre
Physica A: Statistical Mechanics and its Applications 420, 116-123, 2015
63 2015 Direct coexistence methods to determine the solubility of salts in water from numerical simulations. Test case NaCl HM Manzanilla-Granados, H Saint-Martín, R Fuentes-Azcatl, J Alejandre
The Journal of Physical Chemistry B 119 (26), 8389-8396, 2015
54 2015 Thermodynamic and dynamic anomalous behavior in the TIP4P/ε water model R Fuentes-Azcatl, MC Barbosa
Physica A: Statistical Mechanics and its Applications 444, 86-94, 2016
29 2016 Potassium bromide, KBr/ε: New Force Field R Fuentes-Azcatl, MC Barbosa
Physica A: Statistical Mechanics and its Applications 491, 480-489, 2018
25 2018 Flexible bond and angle, FBA/ϵ model of water R Fuentes-Azcatl, MC Barbosa
Journal of Molecular Liquids 303, 112598, 2020
21 2020 Prediction of experimental properties of CO2 : improving actual force fields R Fuentes-Azcatl, H Domínguez
Journal of Molecular Modeling 25, 1-9, 2019
20 2019 Flexible model of water based on the dielectric and electromagnetic spectrum properties: TIP4P/∊ Flex R Fuentes-Azcatl
Journal of Molecular Liquids 338, 116770, 2021
12 2021 Carbon Dioxide Confined Between Two Charged Single Layers of Graphene: Molecular Dynamics Studies R Fuentes-Azcatl, H Dominguez
The Journal of Physical Chemistry C, https://doi.org/10.1021/acs.jpcc.9b05239, 2019
10 2019 Carbon dioxide adsorption on a modified zeolite with sodium dodecyl sulfate surfactants: A molecular dynamics study M Valencia-Ortega, R Fuentes-Azcatl, H Dominguez
Journal of Molecular Graphics and Modelling 1 (on line), https://doi.org/10 …, 2019
9 2019 Dielectric behavior of Water in [bmim][Tf 2 N] room-temperature Ionic Liquid, molecular dynamic study R Fuentes-Azcatl, GJC Araujo, TC Lourenço, CTOG Costa, JWM Carneiro, ...
Theoretical Chemistry Accounts 140, 1-9, 2021
7 2021 Novel force field for the ionic liquid [Bmim][Nf2T] and its transferability in a mixture with water R Fuentes-Azcatl, M González-Melchor
Journal of Molecular Liquids 391, 123343, 2023
4 2023 Dielectric properties of water: a molecular dynamics study on the effects of molecule count and cutoff radius R Fuentes-Azcatl
Journal of Molecular Modeling 30 (207), 1-8, 2024
3 2024 Dielectric Properties of Water with a Low Quantity of NaCl inside Charged Nanoslits R Fuentes-Azcatl
The Journal of Physical Chemistry B, 2025
2025 Dielectric and Structural Study of Water with Various NaCl Concentrations via Molecular Dynamics R Fuentes-Azcatl
arXiv preprint arXiv:2410.18782, 2024
2024 Novel force field of [Bmim][Nf T] and its tranferability in a mixture with water R Fuentes-Azcatl, M González-Melchor
arXiv preprint arXiv:2305.14769, 2023
2023 Water inside charged nanoslits: Structure and Dielectric study with a novel water model FAB/ R Fuentes-Azcatl, JR Bordin, MC Barbosa
arXiv preprint arXiv:2208.05619, 2022
2022 Dielectric and thermodynamic study of Carbon dioxide (CO ) - methanol (CH OH) mixture R Fuentes-Azcatl, H Dominguez
arXiv preprint arXiv:2203.05498, 2022
2022 Supporting Information for Publication” Carbon Dioxide Confined between two Charged Single Layers of Graphene: Molecular Dynamics Studies” R Fuentes-Azcatl, H Domınguez
2019