Forcite structural model optimisation
CuTOTP-OC2 bulk powder/pellet sample · Powder
Materials Studio Forcite model assuming P6/m, c fixed at 3.20 A.
| Property | Reported value | Normalised value | Uncertainty | Origin and quality | Source |
|---|---|---|---|---|---|
| optimised a=b | 36.6807 | — | — | Caption Exact Reported | SI S21 · Supplementary figures · Fig. S5 |