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Temas de Investigación
Líquidos Iónicos
Líquidos Iónicos
En esta área buscamos comprender el comportamiento reológico de los líquidos iónicos mediate estudios experimentales y de simulación con Dinámica Molecular Fuera del Equilibrio.
Trabajos publicados sobre este tema:
EG Blanco-Díaz, G González-Alatorre, FJ Lona-Ramírez, EO Castrejón-González (2021). Effect of increasing the cation chain length on thermodynamic and transport properties of ionic liquids using molecular dynamics, Journal of Molecular Liquids, 334, 116430.
EG Blanco-Díaz, EO Castrejón-González, IY López-Cortés, M Ramos-Estrada, GA Iglesias-Silva, (2019). Thermodynamic and transport properties of 1-allyl-3-methylimidazolium bis(trifluromethylsulfonyl)imide+1-propanol liquid mixtures: A Molecular Dynamics study, Journal of Molecular Liquids, 279, 662-668.
EG Blanco-Díaz, EA Vázquez-Montelongo, G Andrés-Cisneros, EO Castrejón-González, (2018). Computational investigation of non-covalent interactions in 1-butyl 3-methylimidazolium / bis (trifluoromethylsulfonyl)imide [bmim][Tf2N] in EMD and NEMD, Journal of Chemical Physics, 148, 054303.
EG Blanco-Díaz, EO Castrejón-González, JF Javier Alvarado, A Estrada-Baltazar, F Castillo-Borja (2017). Rheological behavior of ionic liquids: Analysis of the H-bond formation by molecular dynamics, Journal of Molecular Liquids, 242, 265-271.
Multimedia1.aviNanocompuestos Poliméricos
Nanocompuestos Poliméricos
Trabajos publicados sobre este tema:
Eduardo Naranjo-Adorno, Edgar O Castrejón-González, Juan FJ Alvarado, Christian O. Díaz-Ovalle, Vicente Rico-Ramírez (2025). Simulation study of hardness via nanoindentation of polymer nanocomposites through molecular dynamics, Journal of Molecular Modeling, 31, 1-15. https://doi.org/10.1007/s00894-025-06403-x
Isidro Montes-Zavala, Edgar O Castrejón-González, José Amir González-Calderón, Vicente Rico-Ramírez (2023). Colloidal stability of graphene in aqueous medium: A theoretical approach through Molecular Dynamics, Journal of Molecular Modeling, 29, 1-9.
Isidro Montes-Zavala, MJ Pérez-González, EO Castrejón-González, Diego A Santamaría-Razo, A Almendárez-Camarillo, E Pérez, JA Gonzalez-Calderon (2022). Thermal and mechanical properties of poly (lactic acid) filled with modified silicon dioxide: importance of the surface area, Polymer Bulletin, 79, 1409-1435.
Isidro Montes-Zavala, EO Castrejón-González, V Rico-Ramírez, Elias Pérez, Diego A Santamaría-Razo, JA González-Calderón (2021). Which is better? Experimental and simulation analyses of the chemical modification of carbon nanotubes to improve their dispersion in water, Journal of Dispersion Science and Technology, 42, 1338-1349.
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