La2Tb12Y5
Alexandria ALEXAlex-ID: agm005654286 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C12_394_spg2
La3Tb5 Tb5Y LaY2
2023-06-26 21:14:43.666669
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005654286).
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 agm005654286
data_agm005654286
_cell_length_a 6.30679
_cell_length_b 12.16265
_cell_length_c 17.38295
_cell_angle_alpha 151.38493
_cell_angle_beta 102.58832
_cell_angle_gamma 79.96760
_cell_volume 622.82544
_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 0.74081 0.04509 0.98763 1.00000
La2 La 0.25919 0.95491 0.01237 1.00000
Tb1 Tb 0.16462 0.11541 0.29300 1.00000
Tb2 Tb 0.26739 0.53528 0.89481 1.00000
Tb3 Tb 0.76195 0.74576 0.96304 1.00000
Tb4 Tb 0.08637 0.54720 0.37861 1.00000
Tb5 Tb 0.54070 0.75007 0.42404 1.00000
Tb6 Tb 0.31364 0.09539 0.76057 1.00000
Tb7 Tb 0.68636 0.90461 0.23943 1.00000
Tb8 Tb 0.91363 0.45281 0.62139 1.00000
Tb9 Tb 0.45930 0.24993 0.57596 1.00000
Tb10 Tb 0.73261 0.46472 0.10519 1.00000
Tb11 Tb 0.23805 0.25425 0.03696 1.00000
Tb12 Tb 0.83538 0.88459 0.70700 1.00000
Y1 Y 0.35579 0.66343 0.65652 1.00000
Y2 Y 0.21416 0.68710 0.17436 1.00000
Y3 Y 1.00000 0.00000 0.50000 1.00000
Y4 Y 0.78584 0.31291 0.82564 1.00000
Y5 Y 0.64421 0.33657 0.34348 1.00000
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