La2SmCu4
Alexandria ALEXAlex-ID: agm014686202 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_1037_spg121
LaCu2 SmCu LaCu
2025-05-01 22:58:47
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm014686202).
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 agm014686202
data_agm014686202
_cell_length_a 3.74176
_cell_length_b 4.38328
_cell_length_c 10.09256
_cell_angle_alpha 102.40761
_cell_angle_beta 100.72214
_cell_angle_gamma 90.01671
_cell_volume 158.70101
_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 0.18095 0.18190 0.36452 1.00000
La2 La 0.81905 0.81810 0.63548 1.00000
Sm1 Sm 0.00000 0.50000 0.00000 1.00000
Cu1 Cu 0.37051 0.37111 0.74116 1.00000
Cu2 Cu 0.62949 0.62889 0.25884 1.00000
Cu3 Cu 0.43827 0.93721 0.87463 1.00000
Cu4 Cu 0.56173 0.06279 0.12537 1.00000
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