nixos/packages/ufo/test/fold/config.yaml
2024-09-14 18:01:29 +08:00

19 lines
323 B
YAML

SuperCellMultiplier: [3, 4, 1]
SuperCellDeformation:
- [ 1, 0, 0 ]
- [ 0.6666, 1, 0 ]
- [ 0, 0, 1 ]
Qpoints:
- [0, 0, 0]
- [0.05, 0, 0]
- [0.1, 0, 0]
- [0.15, 0, 0]
- [0.2, 0, 0]
- [0.25, 0, 0]
- [0.3, 0, 0]
- [0.35, 0, 0]
- [0.4, 0, 0]
- [0.45, 0, 0]
- [0.5, 0, 0]
OutputFile: fold-output.yaml