Exploring the nature of the interactions between the molecules of the sodium dodecyl sulfate and water in crystal phases and in the water/vacuum interface
Aray, Yosslen, Parra, José G., Paredes, Ricardo, Álvarez, Luis Javier, Diaz-Barrios, Antonio
Published in Heliyon (01.06.2020)
Published in Heliyon (01.06.2020)
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Journal Article
Electrostatics for Exploring the Nature of the Hydrogen Bonding in Polyethylene Oxide Hydration
Aray, Yosslen, Marquez, Manuel, Rodríguez, Jesus, Vega, David, Simón-Manso, Yamil, Coll, Santiago, Gonzalez, Carlos, Weitz, David A
Published in The journal of physical chemistry. B (19.02.2004)
Published in The journal of physical chemistry. B (19.02.2004)
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Journal Article
Topology of the Electron Density and Cohesive Energy of the Face-Centered Cubic Transition Metals
Aray, Yosslen, Rodriguez, Jesus, Vega, David
Published in The journal of physical chemistry. B (18.05.2000)
Published in The journal of physical chemistry. B (18.05.2000)
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Journal Article
Electrostatics for Exploring the Nature of Water Adsorption on the Laponite Sheets' Surface
Aray, Yosslen, Marquez, Manuel, Rodríguez, Jesus, Coll, Santiago, Simón-Manso, Yamil, Gonzalez, Carlos, Weitz, David A.
Published in The journal of physical chemistry. B (28.08.2003)
Published in The journal of physical chemistry. B (28.08.2003)
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Journal Article
Exploring the electron density localization in MoS 2 nanoparticles using a localized-electron detector: Unraveling the origin of the one-dimensional metallic sites on MoS 2 catalysts
Aray, Yosslen, Barrios, Antonio Díaz
Published in Physical chemistry chemical physics : PCCP (08.08.2018)
Published in Physical chemistry chemical physics : PCCP (08.08.2018)
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Journal Article
Exploring the electron density localization in MoS2 nanoparticles using a localized-electron detector: Unraveling the origin of the one-dimensional metallic sites on MoS2 catalystsElectronic supplementary information (ESI) available: Fig. S1. Pictures showing that most of the delocalized electrons (LED < 0.3 a.u.) are inside the basins of the Mo atoms at the n8-100S cluster central layer. 2. Electron localized-electron detector analysis for the n6-50S cluster supported on an Au(111) layer. See D
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Distribución del 1-butanol y 2-butanol en los sistemas agua/n-octano y agua/Dodecil ´Sulfato de Sodio (SDS)/n-octano usando dinámica molecular. Parte II. Uso de las herramientas gmx-density y gmx-densmap
Parra, José Gregorio, Aray, Yosslen R., Rodríguez, Geraldine, Perozo, Elizabeth
Published in ACI Avances en Ciencias e Ingenierías (15.06.2019)
Published in ACI Avances en Ciencias e Ingenierías (15.06.2019)
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Journal Article
Structural and interfacial properties of the CO2-in-water foams prepared with sodium dodecyl sulfate (SDS): A molecular dynamics simulation study
Parra, José G., Domínguez, Héctor, Aray, Yosslen, Iza, Peter, Zarate, Ximena, Schott, Eduardo
Published in Colloids and surfaces. A, Physicochemical and engineering aspects (05.10.2019)
Published in Colloids and surfaces. A, Physicochemical and engineering aspects (05.10.2019)
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Journal Article
Molecular Interactions between Orinoco Belt Resins
Castellano, Olga, Gimon, Raquel, Canelon, Carlos, Aray, Yosslen, Soscun, Humberto
Published in Energy & fuels (17.05.2012)
Published in Energy & fuels (17.05.2012)
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Journal Article
Corrigendum to “Structural and interfacial properties of the CO2-in-water foams prepared with sodium dodecyl sulfate (SDS): A molecular dynamics simulation study” [Colloids Surf. A 578 (2019) 615]
Parra, José G., Dominguez, Hector, Aray, Yosslen, Iza, Peter, Zarate, Ximena, Schott, Eduardo
Published in Colloids and surfaces. A, Physicochemical and engineering aspects (05.02.2020)
Published in Colloids and surfaces. A, Physicochemical and engineering aspects (05.02.2020)
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Journal Article
On the electron density localization in elemental cubic ceramic and FCC transition metals by means of a localized electrons detector
Aray, Yosslen, Paredes, Ricardo, Álvarez, Luis Javier, Martiz, Alejandro
Published in The Journal of chemical physics (14.06.2017)
Published in The Journal of chemical physics (14.06.2017)
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Journal Article
Dynamics of Surfactant Clustering at Interfaces and Its Influence on the Interfacial Tension: Atomistic Simulation of a Sodium Hexadecane–Benzene Sulfonate–Tetradecane–Water System
Paredes, Ricardo, Fariñas-Sánchez, Ana Isabel, Medina-Rodrı́guez, Bryan, Samaniego, Samantha, Aray, Yosslen, Álvarez, Luis Javier
Published in Langmuir (06.03.2018)
Published in Langmuir (06.03.2018)
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Journal Article
Exploring the nature of the H-bonds between the human class II MHC protein, HLA-DR1 (DRB0101) and the influenza virus hemagglutinin peptide, HA306-318, using the quantum theory of atoms in molecules
Aray, Yosslen, Aguilera-García, Ricardo, Izquierdo, Daniel R.
Published in Journal of biomolecular structure & dynamics (02.01.2019)
Published in Journal of biomolecular structure & dynamics (02.01.2019)
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