Li4TeN8
Alexandria ALEXAlex-ID: agm097986604 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1927_spg1
LiN3 Li2TeN2
2025-06-22 01:06:15
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097986604).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm097986604
data_agm097986604
_cell_length_a 4.60268
_cell_length_b 7.80479
_cell_length_c 7.13283
_cell_angle_alpha 115.17256
_cell_angle_beta 82.85376
_cell_angle_gamma 94.81991
_cell_volume 229.95867
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Li1 Li 0.38101 0.95346 0.86397 1.00000
Li2 Li 0.80221 0.39496 0.05405 1.00000
Li3 Li 0.35435 0.29805 0.30110 1.00000
Li4 Li 0.02590 0.06507 0.51027 1.00000
Te1 Te 0.86689 0.08319 0.12926 1.00000
N1 N 0.70407 0.24153 0.75187 1.00000
N2 N 0.11101 0.59369 0.98123 1.00000
N3 N 0.39212 0.70527 0.41223 1.00000
N4 N 0.33407 0.28858 0.57830 1.00000
N5 N 0.29867 0.85172 0.53737 1.00000
N6 N 0.51951 0.26775 0.66591 1.00000
N7 N 0.48368 0.55837 0.28781 1.00000
N8 N 0.22651 0.69835 0.92663 1.00000
Get direct link