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Further extension of the Madrid-2019 force field: Parametrization of nitrate (NO3-) and ammonium (NH4+) ions.
J Chem Phys. 2023 Dec 14;159(22):224501. doi: 10.1063/5.0177363.
J Chem Phys. 2023.
PMID: 38063225
Towards the description of adsorption of water in slit-like pores with walls covered by molecular brushes.
Trejos VM, Pizio O, Sokołowski S.
Trejos VM, et al.
J Chem Phys. 2018 Dec 21;149(23):234703. doi: 10.1063/1.5066552.
J Chem Phys. 2018.
PMID: 30579295
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Self-diffusion coefficient of the square-well fluid from molecular dynamics simulations within the constant force approach.
Torres-Carbajal A, Trejos VM, Nicasio-Collazo LA.
Torres-Carbajal A, et al. Among authors: trejos vm.
J Chem Phys. 2018 Oct 14;149(14):144501. doi: 10.1063/1.5031132.
J Chem Phys. 2018.
PMID: 30316277
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Vapor-liquid equilibrium and equation of state of two-dimensional fluids from a discrete perturbation theory.
Trejos VM, Santos A, Gámez F.
Trejos VM, et al.
J Chem Phys. 2018 May 21;148(19):194505. doi: 10.1063/1.5029375.
J Chem Phys. 2018.
PMID: 30307191
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Adsorption and phase behavior of water-like fluid models with square-well attraction and site-site association in slit-like pores: Density functional approach.
Trejos VM, Sokołowski S, Pizio O.
Trejos VM, et al.
J Chem Phys. 2018 Oct 7;149(13):134701. doi: 10.1063/1.5047018.
J Chem Phys. 2018.
PMID: 30292229
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Thermodynamic properties of confined square-well fluids with multiple associating sites.
Trejos VM, Quintana-H J.
Trejos VM, et al.
J Chem Phys. 2018 Feb 21;148(7):074703. doi: 10.1063/1.5009478.
J Chem Phys. 2018.
PMID: 29471659
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Computer simulation of liquid-vapor coexistence of confined quantum fluids.
Trejos VM, Gil-Villegas A, Martinez A.
Trejos VM, et al.
J Chem Phys. 2013 Nov 14;139(18):184505. doi: 10.1063/1.4829769.
J Chem Phys. 2013.
PMID: 24320282
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Semiclassical approach to model quantum fluids using the statistical associating fluid theory for systems with potentials of variable range.
Trejos VM, Gil-Villegas A.
Trejos VM, et al.
J Chem Phys. 2012 May 14;136(18):184506. doi: 10.1063/1.4712299.
J Chem Phys. 2012.
PMID: 22583299
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