Re2Te4
MatHub2d-1674-Re2Te4
| Property |
Value |
| Space group |
(11, 'P2_1/m') |
| Crystal system |
rectangular |
| Magnetic |
Yes |
| Band gap (PBE) (eV) |
0.00 |
| Free energy (eV) |
-31.653 |
| Free energy / atom (eV) |
-5.275 |
Lattice Parameters (basic)
| a, b, c (Å): | 6.311 | 3.458 | 30.000 |
| α, β, γ (°): | 90.000 | 90.000 | 90.000 |
Lattice Parameters (computed)
| a, b, c (Å): | 6.212 | 3.717 | 30.000 |
| α, β, γ (°): | 90.000 | 90.000 | 90.000 |
| Property |
Value |
| Band gap |
0.00 eV |
| E-fermi |
-1.905 eV |
| Vacuum level |
2.428 eV |
| VBM |
-1.907 eV |
| CBM |
-1.905 eV |
| Work function |
4.334 eV |
| Direct gap |
No |
| Property |
Value |
| Band gap |
0.00 eV |
| E-fermi |
-1.905 eV |
| Vacuum level |
2.428 eV |
| VBM |
-1.907 eV |
| CBM |
-1.905 eV |
| Work function |
4.334 eV |
| Cij (N/m) |
xx |
yy |
xy |
| xx |
79.444 |
54.091 |
0.000 |
| yy |
54.091 |
4.795 |
-0.000 |
| xy |
0.000 |
-0.000 |
-198.284 |
| Phonon mode at Γ point (THz) |
| Property |
Value |
| from where |
c2db-1913 |
