Artículos de revistas
SPIN-ORBIT EFFECTS METAL-METAL-MULTIPLE BONDED M2X2 HALIDE COMPLEXES
Autor
HENÁNDEZ-ACEVEDO,LUCÍA
ARRATIA-PÉREZ,RAMIRO
Institución
Resumen
Dirac molecular spinor calculations on the Re2Cl8(2-), Re2Br8(2-), Os2Cl8(2-) (both staggered and eclipsed isomers), Os2Br8(2-) and Os2I8(2-) cluster ions are reported. Here we report the calculations of the spin-orbit splitting affecting the metal and ligand core-like states and also affecting the p and d metal-metal bonds. We also compare the calculated molecular spin-orbit splitting against the calculated atomic spin-orbit splitting, and, against available experimental data