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International Journal of Quantum Chemistry(2)
Journal of Molecular Structure: THEOCHEM(2)
Theoretical Chemistry Accounts(1)
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A density functional theory test study on the N<inf>2</inf>⋯He dimer
ArticleAbstract: In the present contribution we report a study of the weakly bound van der Waals N2-He molecule in thPalabras claves:density functional theory, Energy surface, Van der WaalsAutores:Eduardo V. Ludeña, Hernandez A.J., José Luis Paz, Manzanares I C., Salazar M.C.Fuentes:scopusDensity functional theory test study on the CO ···· He dimer
ArticleAbstract: In the current paper we have investigated the bonding properties of the weakly bound van der Waals CPalabras claves:Ab initio, CO-He, density, functional, Van der WaalsAutores:Eduardo V. Ludeña, Hernandez A.J., José Luis Paz, Manzanares I C., Salazar M.C.Fuentes:scopusAb 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 conformational study of the CO ⃛H<inf>2</inf> van der Waals dimer
ArticleAbstract: Quantum chemical fully ab initio conformational calculations were performed for the weakly bound vanPalabras claves:Autores:De Castro A., Diercksen G.H.F., 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