Journal of Chemical Physics, Vol.102, No.3, 1164-1172, 1995
The Electronic-Structure of Cr-2+,Cr-4+ in Fluoride Host Materials
Keywords:2ND-ORDER PERTURBATION-THEORY;LIGAND-FIELD SPECTRUM;CHARGE-DENSITY;TOPOLOGICAL ANALYSIS;BINUCLEAR COMPLEXES;AB-INITIO;LAPLACIAN;CHROMIUM;SOLIDS;ATOMS