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C6dispersion coefficients from reduced dipole pseudospectra

✍ Scribed by Giuseppe Figari; Marina Rui; Camilla Costa; Valerio Magnasco


Book ID
105886041
Publisher
Springer
Year
2007
Tongue
English
Weight
125 KB
Volume
118
Category
Article
ISSN
1432-2234

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Dipole polarizabilities and C6 dispersio
✍ Valerio Magnasco; Massimo Ottonelli πŸ“‚ Article πŸ“… 1996 πŸ› Elsevier Science 🌐 English βš– 367 KB

An accurate evaluation of C 6 dispersion coefficients for long-range interactions involving H, He, H~-and H 2 has been performed using the London formula in terms of ab initio pseudostate decomposition of the static dipole polafizabilities of the individual atoms and molecules.

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✍ Valerio Magnasco; Massimo Ottonelli πŸ“‚ Article πŸ“… 1996 πŸ› Elsevier Science 🌐 English βš– 339 KB

The pseudostate decomposition of accurate Kolos-Wolniewicz static dipole polarizabilities for ground-state H 2 allows an extremely accurate evaluation of C 6 dispersion coefficients for (H2) 2.