Pr5(SmCo2)2
Alexandria ALEXAlex-ID: agm012853579 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_102_spg71
PrSmCo2 Pr
2024-06-24 11:20:18.244923
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm012853579).
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 agm012853579
data_agm012853579
_cell_length_a 8.82302
_cell_length_b 8.82302
_cell_length_c 9.89876
_cell_angle_alpha 58.72911
_cell_angle_beta 58.72911
_cell_angle_gamma 25.52788
_cell_volume 281.13676
_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
Pr1 Pr 0.25328 0.25328 0.66007 1.00000
Pr2 Pr 0.74672 0.74672 0.33993 1.00000
Pr3 Pr 0.14853 0.14853 0.12555 1.00000
Pr4 Pr 0.50000 0.50000 0.50000 1.00000
Pr5 Pr 0.85147 0.85147 0.87445 1.00000
Sm1 Sm 0.45228 0.45228 0.19968 1.00000
Sm2 Sm 0.54772 0.54772 0.80032 1.00000
Co1 Co 0.66547 0.66547 0.91492 1.00000
Co2 Co 0.10515 0.10515 0.56661 1.00000
Co3 Co 0.33453 0.33453 0.08508 1.00000
Co4 Co 0.89485 0.89485 0.43339 1.00000
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