Table 2. List of stacking events used for disorder modelling in DISCUS and the corresponding interpretation of the local structure.
| Event | Δx | Δy | Δz | P ij | Interpretation |
|---|---|---|---|---|---|
| α + α | 0 | 0 | 1 | (1 − p x)(1 − p y) | Polymorph I |
| α + β | 0 | 0 | 1 | p x(1 − p y) | Polymorph II |
| α + γ | 0 | 0 | 1.120 | p y | Like RUB-6 |
| β + α | 0 | 0 | 1 | p x(1 − p y) | Polymorph II |
| β + β | 0 | 0 | 1 | (1 − p x)(1 − p y) | Polymorph I |
| β + γ | 0 | 0 | 1.120 | p y | Like RUB-6 |
| γ + α | 0 | 0 | 1 | (1 − p y)/2 | Polymorph I |
| γ + β | 0 | 0 | 1 | (1 − p y)/2 | Polymorph II |
| γ + γ | 0 | 0 | 1.120 | p y | Like RUB-6 |