Theoretical study of the nuclear spin-molecular rotation coupling for relativistic electrons and non-relativistic nuclei. II. Quantitative results in HX (X=H,F,Cl,Br,I) compounds
In the present work, numerical results of the nuclear spin-rotation (SR) tensor in the series of compounds HX (X=H,F,Cl,Br,I) within relativistic 4-component expressions obtained by Aucar [J. Chem. Phys. 136, 204119 (2012)10.1063/1.4721627] are presented. The SR tensors of both the H...
Guardado en:
Autores principales: | Aucar, I.A., Gómez, S.S., Melo, J.I., Giribet, C.C., Ruiz De Azúa, M.C. |
---|---|
Formato: | Artículo publishedVersion |
Publicado: |
2013
|
Materias: | |
Acceso en línea: | http://hdl.handle.net/20.500.12110/paper_00219606_v138_n13_p_Aucar https://repositoriouba.sisbi.uba.ar/gsdl/cgi-bin/library.cgi?a=d&c=artiaex&d=paper_00219606_v138_n13_p_Aucar_oai |
Aporte de: |
Ejemplares similares
-
Theoretical study of the nuclear spin-molecular rotation coupling for relativistic electrons and non-relativistic nuclei. II. Quantitative results in HX (X=H,F,Cl,Br,I) compounds
por: Aucar, I.A., et al.
Publicado: (2013) -
Theoretical study of the nuclear spin-molecular rotation coupling for relativistic electrons and non-relativistic nuclei. II. Quantitative results in HX (X=H,F,Cl,Br,I) compounds
por: Aucar, I.A., et al. -
Theoretical study of the nuclear spin-molecular rotation coupling for relativistic electrons and non-relativistic nuclei. II. Quantitative results in HX (X=H,F,Cl,Br,I) compounds
por: Melo, Juan Ignacio, et al.
Publicado: (2013) -
Relativistic effects on nuclear magnetic shieldings of CHnX 4-n and CHXYZ (X, Y, Z = H, F, Cl, Br, I)
por: Melo, J.I., et al. -
Theoretical study of the nuclear spin-molecular rotation coupling for relativistic electrons and non-relativistic nuclei
por: Aucar, I.A., et al.
Publicado: (2012)