Density-functional calculations of the nuclear magnetic shielding and indirect nuclear spin-spin coupling constants of three isomers of C20

By Lutnæs Ola   Helgaker Trygve   Jaszunski Michał  

Molecular Physics, Vol. 106, Iss. 20, 2008-10 ,pp. : 2357-2365

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Ab initio calculation of molecular hydrogen electronic states' properties: fine structure spin-spin constants

By Spielfiedel A.   Palmieri P.   Mitrushenkov A. O.  

Molecular Physics, Vol. 102, Iss. 21-22, 2004-01 ,pp. : 2191-2200

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Finite perturbation theory-density functional theory calculation of the spin-dipolar contribution to NMR spin-spin coupling constants

By Peralta Juan E.   Barone Verónica   De Azúa Martín C. Ruiz   Contreras Rubén H.  

Molecular Physics, Vol. 99, Iss. 8, 2001-04 ,pp. : 655-661

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Density-functional theory calculation of the nuclear magnetic resonance indirect nuclear spin-spin coupling constants in C₆₀

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Molecular Physics, Vol. 101, Iss. 13, 2003-07 ,pp. : 1997-2002

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Ab initio calculation of spin-orbit coupling constants for gaussian lobe and gaussian-type wave functions

By Abegg P.W.  

Molecular Physics, Vol. 30, Iss. 2, 1975-08 ,pp. : 579-596

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