Listar Artículos científicos por autor "Parra, José G."
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Unveiling the hydrophilic nature of SDS surfactant through molecular simulations: Exploring the influence of charge distribution on interfacial properties in the vacuum/SDS/water system (2024)
Parra, José G.; Iza, Peter; Dominguez, Hector; Schott, Eduardo; Zarate, Ximena (Elsevier B.V., 2024)The hydrophilicity of SDS surfactant was evaluated using different charge distributions derived from atomic charges obtained by quantum mechanical calculations. The atomic charges were determined using the Hirshfeld, CM5, ...