Sm3MgCo
Alexandria ALEXAlex-ID: agm005809487 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3_2424_spg12
Sm4Mg3Co2 Sm4MgCo SmCo
2023-07-04 16:22:19.440039
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005809487).
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 agm005809487
data_agm005809487
_cell_length_a 3.67495
_cell_length_b 9.61626
_cell_length_c 8.04811
_cell_angle_alpha 88.85471
_cell_angle_beta 90.00000
_cell_angle_gamma 101.01583
_cell_volume 279.11625
_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 0.03869 0.07738 0.30629 1.00000
Sm2 Sm 0.96131 0.92262 0.69371 1.00000
Sm3 Sm 0.40430 0.80859 0.07457 1.00000
Sm4 Sm 0.59570 0.19141 0.92543 1.00000
Sm5 Sm 0.17385 0.34770 0.59195 1.00000
Sm6 Sm 0.82615 0.65230 0.40805 1.00000
Mg1 Mg 0.78255 0.56509 0.85166 1.00000
Mg2 Mg 0.21745 0.43491 0.14834 1.00000
Co1 Co 0.56355 0.12709 0.59163 1.00000
Co2 Co 0.43645 0.87291 0.40837 1.00000
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