Interactions | A (eV) | B (Å) | C (eV. Å6) |
|
O2−-O2− Zr4+-O2− | 9547.96 1502.11 | 0.2192 0.3477 | 32.0 5.1 | Potential 1 |
O2−-O2− Zr4+-O2− | 9547.96 1502.11 | 0.224 0.345 | 32.0 5.1 | Potential 2 |
O2−-O2− Zr4+-O2− | 22.764 1453.8 | 0.149 0.35 | 112.2 0.0 | L-C Potential |