Tb3YRh
Alexandria ALEXAlex-ID: agm005867591 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3_2711_spg2
Tb5Y Tb3Rh Tb2YRh
2023-07-06 05:37:47.324120
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005867591).
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 agm005867591
data_agm005867591
_cell_length_a 3.76604
_cell_length_b 6.30841
_cell_length_c 12.60063
_cell_angle_alpha 86.85488
_cell_angle_beta 81.40561
_cell_angle_gamma 72.63285
_cell_volume 282.48982
_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 0.44239 0.96070 0.15451 1.00000
Tb2 Tb 0.76848 0.70849 0.75456 1.00000
Tb3 Tb 0.09792 0.17514 0.62902 1.00000
Tb4 Tb 0.98982 0.11188 0.90848 1.00000
Tb5 Tb 0.78169 0.04326 0.39335 1.00000
Tb6 Tb 0.43063 0.62244 0.51630 1.00000
Y1 Y 0.11396 0.49334 0.27874 1.00000
Y2 Y 0.22121 0.55796 0.99963 1.00000
Rh1 Rh 0.78433 0.30833 0.12301 1.00000
Rh2 Rh 0.43033 0.35535 0.78399 1.00000
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