Table 3. Statistical parameters of all HARs considered for the Ag, Mo and synchrotron data.
| Ag data | ||||
| rks-anh_nr | rks_rel | rhf-anh_rel | rks-anh_rel | |
| R(F) (%) | 1.59 | 1.71 | 1.57 | 1.59 |
| w R(F) (%) | 1.78 | 1.90 | 1.76 | 1.78 |
| χ2 | 0.965 | 1.099 | 0.951 | 0.970 |
| GooF | 0.983 | 1.048 | 0.975 | 0.980 |
| ρmax, ρmin (eÅ−3) | 0.63, −0.58 | 1.66, −0.62 | 0.63, −0.54 | 0.63, −0.58 |
| Data, restraints, parameters | 11101, 0, 381 | 11102, 0, 356 | 11102, 0, 381 | 11101, 0, 381 |
| Mo data | ||||
| rks-anh_nr | rks_rel | rhf-anh_rel | rks-anh_rel | |
| R(F) (%) | 1.91 | 2.37 | 1.91 | 1.92 |
| w R(F) (%) | 2.01 | 2.41 | 2.01 | 2.01 |
| χ2 | 1.505 | 2.157 | 1.494 | 1.500 |
| GooF | 1.227 | 1.469 | 1.222 | 1.220 |
| ρmax, ρmin (eÅ−3) | 0.98, −0.89 | 3.54, −0.97 | 1.01, −1.18 | 1.06, −0.97 |
| Data, restraints, parameters | 19255, 0, 381 | 19255, 0, 356 | 19255, 0, 381 | 19255, 0, 381 |
| SP8 data | ||||
| rks-anh_nr | rks_rel | rhf-anh_rel | rks-anh_rel | |
| R(F) (%) | 1.80 | 2.00 | 1.79 | 1.80 |
| w R(F) (%) | 2.78 | 2.94 | 2.78 | 2.78 |
| χ2 | 1.766 | 1.974 | 1.761 | 1.760 |
| GooF | 1.329 | 1.405 | 1.327 | 1.330 |
| ρmax, ρmin (eÅ−3) | 1.13, −0.88 | 3.30, −1.01 | 1.14, −0.82 | 1.20, −0.84 |
| Data, restraints, parameters | 23104, 0, 381 | 23104, 0, 356 | 23103, 0, 381 | 23102, 0, 381 |