LaTb2NdSb4
Alexandria ALEXAlex-ID: agm031677458 · Space group: Imma (#74)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_74_spg74
La5NdSb6 LaNd3Sb4 TbSb
2025-02-06 11:30:27
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm031677458).
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 agm031677458
data_agm031677458
_cell_length_a 8.98059
_cell_length_b 8.98059
_cell_length_c 8.98059
_cell_angle_alpha 119.98325
_cell_angle_beta 120.00033
_cell_angle_gamma 90.01422
_cell_volume 512.21681
_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
La1 La 0.00000 0.00000 0.50000 1.00000
La2 La 0.00000 0.50000 0.00000 1.00000
Tb1 Tb 0.50000 0.50000 0.50000 1.00000
Tb2 Tb 0.50000 0.00000 0.00000 1.00000
Tb3 Tb 0.00000 0.00000 0.00000 1.00000
Tb4 Tb 0.50000 0.00000 0.50000 1.00000
Nd1 Nd 0.50000 0.50000 0.00000 1.00000
Nd2 Nd 0.00000 0.50000 0.50000 1.00000
Sb1 Sb 0.73910 0.24734 0.49176 1.00000
Sb2 Sb 0.25558 0.24734 0.00824 1.00000
Sb3 Sb 0.74442 0.75266 0.99176 1.00000
Sb4 Sb 0.26090 0.75266 0.50824 1.00000
Sb5 Sb 0.25405 0.24886 0.49482 1.00000
Sb6 Sb 0.25405 0.75923 0.00518 1.00000
Sb7 Sb 0.74595 0.24077 0.99482 1.00000
Sb8 Sb 0.74595 0.75114 0.50518 1.00000
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