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Ariadne-88: An ab initio monoconfigurational closed and open shell direct electronic energy calculation using elementary Jacobi rotations
ArticleAbstract: The implementation of the elementary Jacobi rotations algorithm for monoconfigurational electronic ePalabras claves:Autores:Calabuig B., Ramón Carbö-D̈orcaFuentes:scopusMolsimil - 88: Molecular similarity calculations using a CNDO-like approximation
ArticleAbstract: The implementation of a molecular similarity algorithm in a CNDO-like approach has been performed owPalabras claves:Autores:Calabuig B., Ramón Carbö-D̈orcaFuentes:scopus