The orbital and charge ordering in Pr_{1-x}Ca_xMnO_3 (x=0 and 0.5) from the ab initio calculations

V. I. Anisimov, I. S. Elfimov, M. A. Korotin +1

The electronic structure of the doped manganites Pr${}_{1-x}$Ca${}_x$MnO${}_3$ was calculated by the LSDA+U method which takes into account the local Coulomb interaction between d-electr…