Li8Bi4Te
Alexandria ALEXAlex-ID: agm097517818 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1959_spg1
Li2Bi Li2Te LiBi
2025-06-16 13:45:39
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097517818).
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 agm097517818
data_agm097517818
_cell_length_a 5.08130
_cell_length_b 8.25371
_cell_length_c 8.97772
_cell_angle_alpha 125.02534
_cell_angle_beta 83.65046
_cell_angle_gamma 96.16667
_cell_volume 305.99440
_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 0.59958 0.16920 0.31010 1.00000
Li2 Li 0.17771 0.73656 0.88426 1.00000
Li3 Li 0.13652 0.86288 0.33409 1.00000
Li4 Li 0.09000 0.02922 0.73884 1.00000
Li5 Li 0.65299 0.70635 0.12363 1.00000
Li6 Li 0.57530 0.43771 0.74311 1.00000
Li7 Li 0.60087 0.24337 0.96769 1.00000
Li8 Li 0.80486 0.64157 0.55114 1.00000
Bi1 Bi 0.08210 0.30996 0.53387 1.00000
Bi2 Bi 0.33053 0.53935 0.35965 1.00000
Bi3 Bi 0.12731 0.45820 0.99325 1.00000
Bi4 Bi 0.62294 0.97447 0.52649 1.00000
Te1 Te 0.69929 0.89115 0.93387 1.00000
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