Tb3Ga2Cu9
Alexandria ALEXAlex-ID: agm005602902 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C9_126_spg71
TbCu5 TbGaCu Cu
2023-06-14 00:49:05.534428
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005602902).
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 agm005602902
data_agm005602902
_cell_length_a 4.22878
_cell_length_b 7.88609
_cell_length_c 7.88609
_cell_angle_alpha 66.78723
_cell_angle_beta 74.44779
_cell_angle_gamma 74.44778
_cell_volume 228.89791
_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
Tb1 Tb 0.00000 0.00000 0.00000 1.00000
Tb2 Tb 0.70663 0.29337 0.29337 1.00000
Tb3 Tb 0.29337 0.70663 0.70663 1.00000
Ga1 Ga 0.50000 0.30906 0.69094 1.00000
Ga2 Ga 0.50000 0.69094 0.30906 1.00000
Cu1 Cu 0.00000 0.50000 0.50000 1.00000
Cu2 Cu 0.66439 0.97909 0.69213 1.00000
Cu3 Cu 0.33561 0.02091 0.30787 1.00000
Cu4 Cu 0.66439 0.69213 0.97909 1.00000
Cu5 Cu 0.33561 0.30787 0.02091 1.00000
Cu6 Cu 0.86776 0.84665 0.41782 1.00000
Cu7 Cu 0.13224 0.15335 0.58218 1.00000
Cu8 Cu 0.86776 0.41782 0.84665 1.00000
Cu9 Cu 0.13224 0.58218 0.15335 1.00000
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