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Finite-field many-body perturbation theory. VI. Multipole polarizabilities of beryllium. A comparative study

โœ Scribed by Geerd H.F. Diercksen; Andrzej J. Sadlej

Publisher
Elsevier Science
Year
1983
Tongue
English
Weight
513 KB
Volume
77
Category
Article
ISSN
0301-0104

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Electric dipole hyperpolarizability and
Electric dipole hyperpolarizability and quadrupole polarizability of methane from finite-field coupled cluster and fourth-order many-body perturbation theory calculations
โœ George Maroulis ๐Ÿ“‚ Article ๐Ÿ“… 1994 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 562 KB

We rely on a finite-field approach to calculate the static dipole ((u) and quadrupole ( C) polarizability and the first (/3) and second ( y) dipole hyperpolarizability of methane. Our best, CCSD( T) values for LY, /II and the mean value of y and C, obtained at&=2.052 aowitha (lls7p4d2f/6s2pld)[6s4p4