La2Sm2Ho
Alexandria ALEXAlex-ID: agm040236205 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_310_spg139
La3Sm5 LaSm LaHo2
2025-04-16 01:22:51
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm040236205).
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 agm040236205
data_agm040236205
_cell_length_a 3.68706
_cell_length_b 3.68706
_cell_length_c 12.98430
_cell_angle_alpha 81.83850
_cell_angle_beta 98.16150
_cell_angle_gamma 90.05251
_cell_volume 172.92276
_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 0.40123 0.59877 0.30244 1.00000
La2 La 0.59877 0.40123 0.69756 1.00000
Sm1 Sm 0.20018 0.79982 0.90057 1.00000
Sm2 Sm 0.79982 0.20018 0.09943 1.00000
Ho1 Ho 0.00000 0.00000 0.50000 1.00000
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