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5 changes: 5 additions & 0 deletions CHANGELOG.md
Original file line number Diff line number Diff line change
Expand Up @@ -372,6 +372,11 @@ one version).

### Changed

- `Lattice::gallium_nitride()` now uses the measured bulk-crystal cell
`a = 3.1890 Å`, `c = 5.18500 Å` at 300 K (Melnik et al. 1997) instead of
`3.189 Å`, `5.178 Å`; its placeholder `u` follows from the new `a`, `c`.
`GAN_DENSITY_G_CM3` is now the measured 6.1 g/cm³ (Juza and Hahn 1938),
replacing 6.15 (#179).
- **Electron results change for every run that uses the `mermin-melf`
inelastic model** (#342). A Mermin table row at energy `T` now draws its
losses from `(1e-8 T, T]`, the window its rate integral already used,
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2 changes: 1 addition & 1 deletion docs/crystal-orientation.md
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Expand Up @@ -164,7 +164,7 @@ accepted: the orthohexagonal search cell has `4n` sites and

| Preset | `a` | `c` | Internal parameters | Temperature | Source |
|---|---|---|---|---|---|
| `Lattice::gallium_nitride()` | 3.189 Å | 5.178 Å | `u = 1/4 + a²/(3c²)` (**placeholder**, equal bond lengths) | 300 K | Ioffe NSM archive, citing Qian et al. (1996); primary not opened |
| `Lattice::gallium_nitride()` | 3.1890 Å | 5.18500 Å | `u = 1/4 + a²/(3c²)` (**placeholder**, equal bond lengths) | 300 K | Melnik et al., MRS Internet J. Nitride Semicond. Res. 2, 39 (1997), Table 1 (annealed bulk crystal) |
| `Lattice::silicon_carbide_4h()` | 3.08051 Å | 10.0848 Å | `z = 0, 0.18784, 0.24982, 0.43671` | not stated | Bauer et al., Acta Cryst. A 57, 60 (2001), via Mehl et al. (2017), pp. 423, 733 |
| `Lattice::silicon_carbide_6h()` | 3.08129 Å | 15.11976 Å | `z = 0, 0.1254, 0.16675, 0.29215, 0.8335, −0.0415` | not stated | Bauer et al. (2001), via Mehl et al. (2017), pp. 427, 734 |

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