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Caputo, M.C.; Ferraro, M.B.; Bochicchio, R.C.; Lazzeretti, P.; Malagoli, M.; Zanasi, R. "Calculation of molecular magnetic properties in the isoelectronic series PH2-, PH3 and PH4+" (1993) Journal of Molecular Structure: THEOCHEM. 287(C):77-88
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Abstract:

Ab initio coupled Hartree-Fock perturbation theory has been used to evaluate magnetic susceptibility and magnetic shielding tensors of 31P and 1H nuclei in PH2-, PH3 and PH4+. Good agreement between theoretical and experimental data and a satisfactory degree of origin independence of computed values has been found by adopting large polarized basis sets developed ad hoc for magnetic properties. © 1993.

Registro:

Documento: Artículo
Título:Calculation of molecular magnetic properties in the isoelectronic series PH2-, PH3 and PH4+
Autor:Caputo, M.C.; Ferraro, M.B.; Bochicchio, R.C.; Lazzeretti, P.; Malagoli, M.; Zanasi, R.
Filiación:Departamento de Física, F.C.E. y N., Universidad de Buenos Aires, (1428) Ciudad Universitaria, Pab. I, Buenos Aires, Argentina
Dipartimento di Chimica dell'Università degli Studi di Modena, Via Campi 183, 41100 Modena, Italy
Año:1993
Volumen:287
Número:C
Página de inicio:77
Página de fin:88
DOI: http://dx.doi.org/10.1016/0166-1280(93)87206-S
Título revista:Journal of Molecular Structure: THEOCHEM
Título revista abreviado:J. Mol. Struct. THEOCHEM
ISSN:01661280
CODEN:THEOD
Registro:https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_01661280_v287_nC_p77_Caputo

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Citas:

---------- APA ----------
Caputo, M.C., Ferraro, M.B., Bochicchio, R.C., Lazzeretti, P., Malagoli, M. & Zanasi, R. (1993) . Calculation of molecular magnetic properties in the isoelectronic series PH2-, PH3 and PH4+. Journal of Molecular Structure: THEOCHEM, 287(C), 77-88.
http://dx.doi.org/10.1016/0166-1280(93)87206-S
---------- CHICAGO ----------
Caputo, M.C., Ferraro, M.B., Bochicchio, R.C., Lazzeretti, P., Malagoli, M., Zanasi, R. "Calculation of molecular magnetic properties in the isoelectronic series PH2-, PH3 and PH4+" . Journal of Molecular Structure: THEOCHEM 287, no. C (1993) : 77-88.
http://dx.doi.org/10.1016/0166-1280(93)87206-S
---------- MLA ----------
Caputo, M.C., Ferraro, M.B., Bochicchio, R.C., Lazzeretti, P., Malagoli, M., Zanasi, R. "Calculation of molecular magnetic properties in the isoelectronic series PH2-, PH3 and PH4+" . Journal of Molecular Structure: THEOCHEM, vol. 287, no. C, 1993, pp. 77-88.
http://dx.doi.org/10.1016/0166-1280(93)87206-S
---------- VANCOUVER ----------
Caputo, M.C., Ferraro, M.B., Bochicchio, R.C., Lazzeretti, P., Malagoli, M., Zanasi, R. Calculation of molecular magnetic properties in the isoelectronic series PH2-, PH3 and PH4+. J. Mol. Struct. THEOCHEM. 1993;287(C):77-88.
http://dx.doi.org/10.1016/0166-1280(93)87206-S