Relativistic effects on nuclear magnetic shielding constants in HX and CH3X (X=Br,I) based on the linear response within the elimination of small component approach
Melo, J I, Ruiz de Azua, M C, Giribet, C G, Aucar, G A, Provasi, P F
Published in The Journal of chemical physics (08.10.2004)
Published in The Journal of chemical physics (08.10.2004)
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Proximity Effects on Nuclear Spin-Spin Coupling Constants. 1. J(CH) Couplings in the Vicinity of an Atom Bearing Lone Pairs
Vizioli, C, Ruiz de Azua, M. C, Giribet, C. G, Contreras, R. H, Turi, L, Dannenberg, J. J, Rae, I. D, Weigold, J. A, Malagoli, M
Published in Journal of physical chemistry (1952) (01.09.1994)
Published in Journal of physical chemistry (1952) (01.09.1994)
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Polarization propagator analysis of the through space transmission of spin—spin coupling constants by overlap of lone pairs
Giribet, C.G., de Azúa, M.C.Ruiz, Contreras, R.H., de Bonczok, R.Lobayan, Aucar, G.A., Gómez, S.
Published in Journal of molecular structure (03.12.1993)
Published in Journal of molecular structure (03.12.1993)
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Expansion of atomic orbital products in terms of a complete function set
P rez, J. E., Cuenya, H. H., Contreras, R. H., Ortiz, F. S., Grinberg, H., Ruiz Az a, M. C., Giribet, C. G.
Published in Theoretica Chimica Acta (01.04.1994)
Published in Theoretica Chimica Acta (01.04.1994)
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Theoretical and experimental study of the orientational nitrogen lone-pair effect on 1J(13C-13C) couplings in acetoxime
KRIVDIN, L. B, ZINCHENKO, S. V, SHCHERBAKOV, V. V, KALABIN, G. A, CONTRERAS, R. H, TUFRO, M. F, RUIZ DE AZUA, M. C, GIRIBET, C. G
Published in Journal of magnetic resonance (1969) (01.08.1989)
Published in Journal of magnetic resonance (1969) (01.08.1989)
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C3(SINGLE BOND)Mα Bond contribution to polarizability tensor and 3J(C1Mα) NMR coupling constant in 1-X-3-M-bicyclo[1.1.1]pentanes
Giribet, C. G., de Azúa, M. C. Ruiz, Gómez, S. B., Botek, E. L., Contreras, R. H., Adcock, W., Della, E. W., Krstic, A. R., Lochert, I. J.
Published in Journal of computational chemistry (30.01.1998)
Published in Journal of computational chemistry (30.01.1998)
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2J(SeSe) couplings in diseleno-substituted alkenylic compounds. A CLOPPA-IPPP analysis
Cavasotto, C.N, Giribet, C.G, de Azúa, M.C.Ruiz, Contreras, R.H, Pérez, J.E
Published in Journal of magnetic resonance (1969) (01.04.1990)
Published in Journal of magnetic resonance (1969) (01.04.1990)
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C3(SINGLE BOND)M? Bond contribution to polarizability tensor and3J(C1M?) NMR coupling constant in 1-X-3-M-bicyclo[1.1.1]pentanes
Giribet, C. G., de Az a, M. C. Ruiz, G mez, S. B., Botek, E. L., Contreras, R. H., Adcock, W., Della, E. W., Krstic, A. R., Lochert, I. J.
Published in Journal of computational chemistry (30.01.1998)
Published in Journal of computational chemistry (30.01.1998)
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Ab initio 'CLOPPA' decomposition of the static molecular polarizability tensor
GIRIBET, By CLAUDIA G., DOLORES DEMARCO, MA, RUIZ DE AZUA, MARTIN C., CONTRERAS, RUBEN H.
Published in Molecular physics (01.05.1997)
Published in Molecular physics (01.05.1997)
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Ab initio and experimental study of NMR coupling constants in bicyclo[1.1.1]pentane
Lazzeretti, Paolo, Malagoli, Massimo, Zanasi, Riccardo, Delia, Ernest W., Lochert, Ian J., Giribet, Claudia G., de Azúa, Martín C. Ruiz, Contreras, Rubén H.
Published in Journal of the Chemical Society. Faraday transactions (1995)
Published in Journal of the Chemical Society. Faraday transactions (1995)
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