Electronic structure of magnetic molecules V15: LDA+U calculations, X-ray emission and photoelectron spectra

D. W. Boukhvalov, E. Z. Kurmaev, A. Moewes +10

Electronic structure of V${}_{15}$ magnetic molecules (K${}_6$ [V${}_{15}$ As${}_6$ O${}_{42}$ (H${}_2$O)] \cdot 8H${}_2$O)$ has been studied using LSDA+U band structure calculations, and measur…