Table 2. Symmetry-operator reliabilities (R symop) for alternate models (%).
Operator short notation† | Model A2 (Icalc) | Model A2 (Iobs) | Model A3 (Icalc) | Model A3 (Iobs) |
---|---|---|---|---|
1.6 | 3.8 | 2.5 | 4.3 | |
2z | 0.0 | 0.0 | 2.8 | 3.6 |
2y | 27.4 | 42.2 | 27.3 | 42.8 |
2x | 27.4 | 42.2 | 27.3 | 42.9 |
2xy | 27.4 | 42.2 | 27.3 | 42.4 |
27.4 | 42.2 | 27.3 | 42.1 |
Rotation-axis directions are expressed in the reference setting of the tetragonal structure, A1, thus the fourfold along z.