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Calculation of the defect kinetic energy in Kohn-Sham theory by means of local-scaling transformations
ArticleAbstract: The kinetic-energy difference ΔT=T-Ts[ρ0] is calculated for the helium isoelectronic series and forPalabras claves:Autores:Eduardo V. Ludeña, Koga T., Kryachko E.S., López‐boada R., Maldonado J.E.Fuentes:scopusFormulation of N- and v-representable density-functional theory. I. Ground states
ArticleAbstract: A rigorous version of N- and v-representable energy density-functional theory, formulated in the conPalabras claves:Autores:Eduardo V. Ludeña, Kryachko E.S.Fuentes:scopusFormulation of N- and v-representable density-functional theory. II. Spin-dependent systems
ArticleAbstract: The local-scaling transformation version of density-functional theory is extended to the case of spiPalabras claves:Autores:Eduardo V. Ludeña, Kryachko E.S.Fuentes:scopusNecessary conditions for the mapping of into
ArticleAbstract: We have obtained necessary conditions for the mapping of the reduced first-order density operator inPalabras claves:Autores:Eduardo V. Ludeña, Sierraalta A.Fuentes:scopusMany-electron energy-density-functional theory: Point transformations and one-electron densities
ArticleAbstract: A novel approach to energy-density-functional theory, based on point transformations in coordinate tPalabras claves:Autores:Eduardo V. Ludeña, Kryachko E.S.Fuentes:scopusLocal-scaling density-functional method: Intraorbit and interorbit density optimizations
ArticleAbstract: The recently proposed local-scaling density-functional theory provides us with a practical method foPalabras claves:Autores:Eduardo V. Ludeña, Koga T., Yamamoto Y.Fuentes:scopus