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Band-Gap Engineering: Lithium Effect on the Electronic Properties of Hydrogenated 3C-SiC (1 1 0) Surfaces
ArticleAbstract: Silicon carbide has structural strength, high electronic conductivity, low diffusion barrier and higPalabras claves:band-gap, DFT, DOS, Electronic properties, Formation energy, GGA framework, lithium batteries, PDOS, SiC-Li, surfacesAutores:José Luis Cuevas, Martínez M.O., Saravana Prakash ThirumuruganandhamFuentes:googlescopusAb Initio Calculations of Chitosan Effects on the Electronic Properties of Unpassivated Triangular ZnO Nanowires Oriented along [0001] Directions
ArticleAbstract: In recent years, both chitosan and ZnO nanostructures have been identified as potential antibacteriaPalabras claves:Autores:Baños A.T., Duncan John Mowbray, José Luis Cuevas Figueroa, Martínez M.O., Saravana Prakash Thirumuruganandham, Terencio T.Fuentes:googlescopusExperimental Studies on TiO<inf>2</inf> NT with Metal Dopants through Co-Precipitation, Sol–Gel, Hydrothermal Scheme and Corresponding Computational Molecular Evaluations
ReviewAbstract: In the last decade, TiO2 nanotubes have attracted the attention of the scientific community and induPalabras claves:co-precipitation, DFT, Hydrothermal, metal oxide, metallic dopants, molecular dynamics, nanobatteries, rutile and anatase nanotube, Sol–gel, SynthesisAutores:Eduardo Patricio Estévez Ruiz, Lago J.L., Saravana Prakash ThirumuruganandhamFuentes:googlescopusWater evaporation and conformational changes from partially solvated ubiquitin
ArticleAbstract: Using molecular dynamics simulation, we study the evaporation of water molecules off partially solvaPalabras claves:Autores:Saravana Prakash Thirumuruganandham, Urbassek H.M.Fuentes:googlescopus