| Axis | x | y | z | Periodic |
|---|---|---|---|---|
| 1 | 15.002 | -8.662 | 0.000 | True |
| 2 | 0.000 | 17.323 | 0.000 | True |
| 3 | 0.000 | 0.000 | 2.480 | True |
| Lengths: | 17.323 | 17.323 | 2.480 |
| Angles: | 90.000 | 90.000 | 120.000 |
| Key | Description | Value |
|---|---|---|
| density | density | 0.804 |
| space_group_number | space_group_number | 175 |
| volume | Volume of unit cell | 644.647 ų |
| mace_energy | mace_energy | -9.130 |
| mass | Sum of atomic masses in unit cell | 312.286 au |
| pearson_symbol | pearson_symbol | hP26 |
| pbc | Periodic boundary conditions | [ True True True] |
| natoms | Number of atoms | 26 |
| topology | topology | aaa |
| wps | wps | ['6j', '6j', '2c', '6k', '6k'] |
| dimension | dimension | 3 |
| formula | Chemical formula | C26 |