Tb2Sm5Ho3
Alexandria ALEXAlex-ID: agm003345409 · Space group: Ibam (#72)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C5_152_spg72
Tb2Ho TbSm4Ho Tb(SmHo3)2
2022-02-02 13:50:20.255810
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003345409).
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 agm003345409
data_agm003345409
_cell_length_a 10.91033
_cell_length_b 9.90845
_cell_length_c 9.90845
_cell_angle_alpha 56.46935
_cell_angle_beta 56.59483
_cell_angle_gamma 56.59481
_cell_volume 697.08328
_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 0.12209 0.78611 0.96971 1.00000
Tb2 Tb 0.87791 0.21389 0.03029 1.00000
Tb3 Tb 0.62209 0.96971 0.78611 1.00000
Tb4 Tb 0.37791 0.03029 0.21389 1.00000
Sm1 Sm 0.25000 0.50000 0.50000 1.00000
Sm2 Sm 0.75000 0.50000 0.50000 1.00000
Sm3 Sm 0.49822 0.75178 0.75178 1.00000
Sm4 Sm 0.00178 0.24822 0.24822 1.00000
Sm5 Sm 0.50178 0.24822 0.24822 1.00000
Sm6 Sm 0.99822 0.75178 0.75178 1.00000
Sm7 Sm 0.12699 0.47297 0.27305 1.00000
Sm8 Sm 0.87301 0.52703 0.72695 1.00000
Sm9 Sm 0.62699 0.27305 0.47297 1.00000
Sm10 Sm 0.37301 0.72695 0.52703 1.00000
Ho1 Ho 0.25000 0.00000 0.00000 1.00000
Ho2 Ho 0.75000 0.00000 0.00000 1.00000
Ho3 Ho 0.37592 0.37472 0.87344 1.00000
Ho4 Ho 0.62408 0.62528 0.12656 1.00000
Ho5 Ho 0.87592 0.87344 0.37472 1.00000
Ho6 Ho 0.12408 0.12656 0.62528 1.00000
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