Al2CuTe4Au
Alexandria ALEXAlex-ID: agm011096366 · Space group: I-4 (#82)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_40_spg121
AlTe2Au AlCuTe2
2025-06-30 17:23:40
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011096366).
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
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# CIF generated by HEAS from Alexandria entry agm011096366
data_agm011096366
_cell_length_a 7.53254
_cell_length_b 7.53254
_cell_length_c 7.53254
_cell_angle_alpha 131.37151
_cell_angle_beta 131.37151
_cell_angle_gamma 71.22349
_cell_volume 235.62028
_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
Al1 Al 0.50000 0.50000 0.00000 1.00000
Al2 Al 0.75000 0.25000 0.50000 1.00000
Cu1 Cu 0.00000 0.00000 0.00000 1.00000
Te1 Te 0.37250 0.35916 0.49136 1.00000
Te2 Te 0.86779 0.88114 0.50864 1.00000
Te3 Te 0.64084 0.13221 0.01334 1.00000
Te4 Te 0.11886 0.62750 0.98666 1.00000
Au1 Au 0.25000 0.75000 0.50000 1.00000
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