Abstract:
Perturbation theory has been applied to evaluate the induced electronic moments and magnetic field at the nuclei of an SF6 molecule interacting with an external magnetic field with a spatially uniform gradient. Contributions to magnetic susceptibility and magnetic shielding of the nuclei have been evaluated using the random phase approximation within the framework of accurate Hartree-Fock zero order wavefuctions. The quality of the calculations has been judged by the fulfillment of sum rules for the origin dependence of the response properties.
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Citas:
---------- APA ----------
Caputo, M.C. & Ferraro, M.B.
(1997)
. Theoretical study of the magnetic properties of an SF6 molecule in non-uniform magnetic field. Journal of Molecular Structure: THEOCHEM, 390(1-3), 47-55.
http://dx.doi.org/10.1016/S0166-1280(96)04758-6---------- CHICAGO ----------
Caputo, M.C., Ferraro, M.B.
"Theoretical study of the magnetic properties of an SF6 molecule in non-uniform magnetic field"
. Journal of Molecular Structure: THEOCHEM 390, no. 1-3
(1997) : 47-55.
http://dx.doi.org/10.1016/S0166-1280(96)04758-6---------- MLA ----------
Caputo, M.C., Ferraro, M.B.
"Theoretical study of the magnetic properties of an SF6 molecule in non-uniform magnetic field"
. Journal of Molecular Structure: THEOCHEM, vol. 390, no. 1-3, 1997, pp. 47-55.
http://dx.doi.org/10.1016/S0166-1280(96)04758-6---------- VANCOUVER ----------
Caputo, M.C., Ferraro, M.B. Theoretical study of the magnetic properties of an SF6 molecule in non-uniform magnetic field. J. Mol. Struct. THEOCHEM. 1997;390(1-3):47-55.
http://dx.doi.org/10.1016/S0166-1280(96)04758-6