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Electron dynamics in extended systems within real-time time-dependent density-functional theory
ArticleAbstract: Abstract: Due to a beneficial balance of computational cost and accuracy, real-time time-dependent dPalabras claves:2d materials, Computation/computing, METAL, Quantum effects, Radiation effects, SemiconductingAutores:Alfredo A. Correa, Andrade X., Baczewski A.D., Constantinescu E., dos Santos T.P., Kanai Y., Kononov A., Lee C.W., Modine N., Robinson B., Schleife A., Yao Y.Fuentes:scopusPlane-wave pseudopotential implementation of explicit integrators for time-dependent Kohn-Sham equations in large-scale simulations
ArticleAbstract: Explicit integrators for real-time propagation of time-dependent Kohn-Sham equations are compared rePalabras claves:Autores:Alfredo A. Correa, Draeger E.W., Kanai Y., Schleife A.Fuentes:scopus