La2CuTe
Alexandria ALEXAlex-ID: agm005756437 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2_434_spg63
LaCu LaTe
2023-07-12 00:13:50.983352
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005756437).
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 agm005756437
data_agm005756437
_cell_length_a 4.70833
_cell_length_b 4.27813
_cell_length_c 12.14539
_cell_angle_alpha 100.14392
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 240.81875
_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 0.75000 0.67217 0.34435 1.00000
La2 La 0.25000 0.32783 0.65565 1.00000
La3 La 0.75000 0.94254 0.88509 1.00000
La4 La 0.25000 0.05746 0.11491 1.00000
Cu1 Cu 0.25000 0.46707 0.93415 1.00000
Cu2 Cu 0.75000 0.53293 0.06585 1.00000
Te1 Te 0.25000 0.19220 0.38440 1.00000
Te2 Te 0.75000 0.80780 0.61560 1.00000
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