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International Journal of Modern Physics B(1)
Lecture Notes in Engineering and Computer Science(1)
Proceedings of SPIE - The International Society for Optical Engineering(1)
Surface Review and Letters(1)
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Química física(4)
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Geometry of dopamine adsorption on rutile (110) surface
ArticleAbstract: Density functional theory (DFT) and generalized gradient approximation (GGA) have been employed to sPalabras claves:Adsorption, band-gap narrowing, DFT + U, dopamine, TiO rutile 2Autores:A. Stashans, Castillo P., D. Castillo Malla, Darwin Patricio Castillo Malla, J. Ontaneda Rojas, Jorge Ontaneda, Stashans A.Fuentes:googlerraaescopusDopamine adsorption configurations on anatase (101) surface
ArticleAbstract: Present work is based on the density functional theory (DFT) and generalized gradient approximationPalabras claves:Adsorption, dft+u, dopamine, TiO anatase 2Autores:A. Stashans, Castillo P., D. Castillo Malla, Darwin Patricio Castillo Malla, F. Marcillo, Ing. Quím. Freddy Marcillo Rivadeneira, Stashans A.Fuentes:googlerraaescopusPeriodic DFT study of molecular crystals
Conference ObjectAbstract: Two molecular crystals have been studied using the first-principles density functional theory calculPalabras claves:DFT, Electronic properties, molecular crystals, StructureAutores:A. Stashans, Castillo P., D. Castillo Malla, R. Rivera Escobar, Richard Rivera, Soraya Jácome, Stashans A.Fuentes:rraaescopusTwenty natural organic pigments for application in dye sensitized solar cells
Conference ObjectAbstract: In this work we present the results of a study of twenty natural pigments obtained from plants and iPalabras claves:DSSCs, Natural dye, Natural pigments, solar cellsAutores:A. Guaman, A. Sánchez-Juárez, Castillo P., D. Castillo Malla, D. Obregón, D. Obregón Calderón, Darwin Patricio Castillo Malla, S. Espinosa TapiaFuentes:googlerraaescopus