La4Tb2Er5
Alexandria ALEXAlex-ID: agm005646629 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_784_spg2
LaTb La3Tb5 LaEr2
2023-06-22 00:39:23.991026
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005646629).
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 agm005646629
data_agm005646629
_cell_length_a 3.56044
_cell_length_b 10.05844
_cell_length_c 11.53467
_cell_angle_alpha 79.10226
_cell_angle_beta 76.28051
_cell_angle_gamma 70.83860
_cell_volume 376.27231
_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 0.25348 0.12746 0.33741 1.00000
La2 La 0.93219 0.33244 0.00081 1.00000
La3 La 0.74652 0.87254 0.66259 1.00000
La4 La 0.06781 0.66756 0.99919 1.00000
Tb1 Tb 0.48994 0.47612 0.25352 1.00000
Tb2 Tb 0.51006 0.52388 0.74648 1.00000
Er1 Er 0.91609 0.16229 0.75870 1.00000
Er2 Er 0.08391 0.83771 0.24130 1.00000
Er3 Er 0.62422 0.65384 0.46297 1.00000
Er4 Er 0.50000 0.00000 0.00000 1.00000
Er5 Er 0.37578 0.34616 0.53703 1.00000
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