Tb6AlNi3
Alexandria ALEXAlex-ID: agm013407752 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C6_57_spg146
Tb4AlNi TbNi
2024-05-28 08:52:03.919462
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm013407752).
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 agm013407752
data_agm013407752
_cell_length_a 5.18641
_cell_length_b 6.08038
_cell_length_c 8.23204
_cell_angle_alpha 96.75380
_cell_angle_beta 98.87957
_cell_angle_gamma 113.29492
_cell_volume 230.97017
_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 0.55656 0.69098 0.48259 1.00000
Tb2 Tb 0.83296 0.01775 0.87401 1.00000
Tb3 Tb 0.89973 0.31758 0.51034 1.00000
Tb4 Tb 0.15825 0.62930 0.90618 1.00000
Tb5 Tb 0.15984 0.95581 0.30883 1.00000
Tb6 Tb 0.57734 0.37581 0.10330 1.00000
Al1 Al 0.44082 0.28930 0.72287 1.00000
Ni1 Ni 0.62861 0.93039 0.18681 1.00000
Ni2 Ni 0.16873 0.85085 0.62957 1.00000
Ni3 Ni 0.09855 0.37781 0.19862 1.00000
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