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"Is the spin-orbit coupling important in the prediction of the ..."

Giovanni Micera, Eugenio Garribba (2011)

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DOI: 10.1002/JCC.21862

access: closed

type: Journal Article

metadata version: 2020-05-30

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Giovanni Micera, Eugenio Garribba:
Is the spin-orbit coupling important in the prediction of the ⁵¹V hyperfine coupling constants of V^IVO²⁺ species? ORCA versus Gaussian performance and biological applications. J. Comput. Chem. 32(13): 2822-2835 (2011)

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