Tb5Te5Ir
Alexandria ALEXAlex-ID: agm003673547 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C5_0_spg12
Tb6Te5Ir Tb3Te4 TbIr2
2022-04-09 18:16:55.386992
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003673547).
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 agm003673547
data_agm003673547
_cell_length_a 6.16508
_cell_length_b 7.57417
_cell_length_c 8.59338
_cell_angle_alpha 107.33963
_cell_angle_beta 90.00000
_cell_angle_gamma 114.01528
_cell_volume 346.47662
_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 0.85174 0.70348 0.15036 1.00000
Tb2 Tb 0.85097 0.70195 0.69328 1.00000
Tb3 Tb 0.50000 0.00000 0.00000 1.00000
Tb4 Tb 0.14903 0.29805 0.30672 1.00000
Tb5 Tb 0.14826 0.29652 0.84964 1.00000
Te1 Te 0.68228 0.36456 0.33337 1.00000
Te2 Te 0.66602 0.33204 0.82467 1.00000
Te3 Te 0.00000 0.00000 0.50000 1.00000
Te4 Te 0.33398 0.66796 0.17533 1.00000
Te5 Te 0.31772 0.63544 0.66663 1.00000
Ir1 Ir 0.00000 0.00000 0.00000 1.00000
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