Tb3Y5Sn
Alexandria ALEXAlex-ID: agm072624005 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C5_1096_spg8
Tb2Y7 Tb5Y Y5Sn3
2024-09-25 23:10:51.176196
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072624005).
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 agm072624005
data_agm072624005
_cell_length_a 5.42678
_cell_length_b 6.73550
_cell_length_c 8.59813
_cell_angle_alpha 101.24201
_cell_angle_beta 90.01144
_cell_angle_gamma 113.78101
_cell_volume 280.98710
_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 0.07353 0.57034 0.43417 1.00000
Tb2 Tb 0.45824 0.33998 0.51872 1.00000
Tb3 Tb 0.76289 0.94920 0.46853 1.00000
Y1 Y 0.98694 0.39713 0.81477 1.00000
Y2 Y 0.29375 0.01117 0.76684 1.00000
Y3 Y 0.52164 0.46538 0.13442 1.00000
Y4 Y 0.67404 0.77173 0.85004 1.00000
Y5 Y 0.22811 0.87844 0.15186 1.00000
Sn1 Sn 0.87505 0.17176 0.13941 1.00000
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