Tb3Al2Ni
Alexandria ALEXAlex-ID: agm012686249 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_2566_spg14
TbAl TbAlNi Tb4AlNi
2025-04-13 12:49:44
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm012686249).
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 agm012686249
data_agm012686249
_cell_length_a 6.09305
_cell_length_b 9.23560
_cell_length_c 10.23094
_cell_angle_alpha 90.00000
_cell_angle_beta 104.85245
_cell_angle_gamma 90.00000
_cell_volume 556.48990
_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 0.20950 0.58109 0.91182 1.00000
Tb2 Tb 0.79050 0.08109 0.58818 1.00000
Tb3 Tb 0.78513 0.68494 0.59839 1.00000
Tb4 Tb 0.21487 0.18494 0.90161 1.00000
Tb5 Tb 0.39784 0.61870 0.26635 1.00000
Tb6 Tb 0.60216 0.11870 0.23365 1.00000
Tb7 Tb 0.39784 0.88130 0.76635 1.00000
Tb8 Tb 0.60216 0.38130 0.73365 1.00000
Tb9 Tb 0.78513 0.81506 0.09839 1.00000
Tb10 Tb 0.21487 0.31506 0.40161 1.00000
Tb11 Tb 0.20950 0.91891 0.41182 1.00000
Tb12 Tb 0.79050 0.41891 0.08818 1.00000
Al1 Al 0.93457 0.87944 0.84542 1.00000
Al2 Al 0.06543 0.37944 0.65458 1.00000
Al3 Al 0.27582 0.88712 0.07554 1.00000
Al4 Al 0.72418 0.38712 0.42446 1.00000
Al5 Al 0.27582 0.61288 0.57554 1.00000
Al6 Al 0.72418 0.11288 0.92446 1.00000
Al7 Al 0.93457 0.62056 0.34542 1.00000
Al8 Al 0.06543 0.12056 0.15458 1.00000
Ni1 Ni 0.69175 0.85646 0.36619 1.00000
Ni2 Ni 0.30825 0.35646 0.13381 1.00000
Ni3 Ni 0.69175 0.64354 0.86619 1.00000
Ni4 Ni 0.30825 0.14354 0.63381 1.00000
