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2011Micera, Giovanni and Garribba, Eugenio (2011) Is the spin-orbit coupling important in the prediction of the 51V hyperfine coupling constants of VIVO2+ species? ORCA versus Gaussian performance and biological applications. Journal of Computational Chemistry, Vol. 32 (13), p. 2822-2835. ISSN 0192-8651. eISSN 1096-987X. Article. |