Figure 3
(a) A single Ni atom at 2.9475 Å, computed using the NiO MT potentials (blue) and the LaNiO3 MT potentials (red), as . The third trace (green) shows the third shell Ni scatterer from LaNiO3 shifted by 0.8902 Å to 2.9475 Å. (b) The magnitude and real part of the Fourier transforms of those three calculations. The vertical black lines represent the Fourier transform and fitting ranges used in the analysis of the data from the mixed sample. |