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Ab initio basis set study of the CO···He van der Waals interaction
Conference ObjectAbstract: The ab initio potential energy surface for the weakly bound van der Waals CO···He has been performedPalabras claves:Ab-initio calculations, Carbon monoxide, Van der WaalsAutores:Hernandez A.J., José Luis Paz, Salazar M.C.Fuentes:scopusAb initio excitation spectrum of the CO-Ar van der Waals molecule
ArticleAbstract: In the present contribution, we performed ab initio calculations at the CCSD(T) level of theory in tPalabras claves:BSSE, CCSD(T), Excitation energy, Van der Waals, Vibrational frequenciesAutores:Castejón H., Hernandez A.J., José Luis Paz, Salazar M.C.Fuentes:scopusAb initio test study of the N<inf>2</inf>...H<inf>2</inf> and N<inf>2</inf>...He van der Waals dimers
Conference ObjectAbstract: Quantum chemical fully ab initio conformational calculations was performed for the weakly bound vanPalabras claves:Dihydrogen, Dinitrogen, Van der Waals dimersAutores:Hernandez A.J., José Luis Paz, Salazar M.C.Fuentes:scopus