La6GeBi2Te3
Alexandria ALEXAlex-ID: agm037561565 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_1_spg12
La3Bi2Te La3GeTe2
2024-12-05 05:46:11
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm037561565).
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 agm037561565
data_agm037561565
_cell_length_a 7.99952
_cell_length_b 7.99952
_cell_length_c 7.96003
_cell_angle_alpha 80.34432
_cell_angle_beta 99.65568
_cell_angle_gamma 60.00830
_cell_volume 415.61699
_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
La1 La 0.39649 0.92106 0.23792 1.00000
La2 La 0.23606 0.76394 0.75914 1.00000
La3 La 0.60351 0.07894 0.76208 1.00000
La4 La 0.07894 0.60351 0.23792 1.00000
La5 La 0.76394 0.23606 0.24086 1.00000
La6 La 0.92106 0.39649 0.76208 1.00000
Ge1 Ge 0.00000 0.00000 0.00000 1.00000
Bi1 Bi 0.33434 0.33434 0.00000 1.00000
Bi2 Bi 0.66566 0.66566 0.00000 1.00000
Te1 Te 0.17202 0.17202 0.50000 1.00000
Te2 Te 0.82798 0.82798 0.50000 1.00000
Te3 Te 0.50000 0.50000 0.50000 1.00000
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