First-principles-based calculation of branching ratio for 5$\mathbf{d}$, 4$\mathbf{d}$, and 3$\mathbf{d}$ transition metal systems

Do Hoon Kiem, Jae-Hoon Sim, Hongkee Yoon +1

A new first-principles computation scheme to calculate `branching ratio' has been applied to various $5d$, $4d$, and $3d$ transition metal elements and compounds. This recently sug…