Sm3(Cu2Ni)2
Alexandria ALEXAlex-ID: agm005605628 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_600_spg12
Sm2CuNi2 Sm3Cu2Ni7 SmCu2
2023-06-27 16:37:08.804728
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005605628).
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 agm005605628
data_agm005605628
_cell_length_a 4.15494
_cell_length_b 5.64180
_cell_length_c 8.49382
_cell_angle_alpha 67.55638
_cell_angle_beta 75.84262
_cell_angle_gamma 68.39362
_cell_volume 169.83740
_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
Sm1 Sm 0.32720 0.68619 0.65940 1.00000
Sm2 Sm 0.00000 0.00000 0.00000 1.00000
Sm3 Sm 0.67280 0.31381 0.34060 1.00000
Cu1 Cu 0.27945 0.38313 0.05796 1.00000
Cu2 Cu 0.72055 0.61687 0.94204 1.00000
Cu3 Cu 0.04874 0.28542 0.61710 1.00000
Cu4 Cu 0.95126 0.71458 0.38290 1.00000
Ni1 Ni 0.39318 0.94031 0.27332 1.00000
Ni2 Ni 0.60682 0.05969 0.72668 1.00000
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