Pm(NdSm2)2
Alexandria ALEXAlex-ID: agm024165255 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_190_spg87
NdSm5 PmNd3Sm4 PmSm2
2025-04-18 15:55:46
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024165255).
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 agm024165255
data_agm024165255
_cell_length_a 6.31292
_cell_length_b 6.31292
_cell_length_c 8.15450
_cell_angle_alpha 82.59525
_cell_angle_beta 97.40475
_cell_angle_gamma 131.77849
_cell_volume 239.91864
_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
Pm1 Pm 0.00000 0.00000 0.50000 1.00000
Nd1 Nd 0.85719 0.14281 0.07171 1.00000
Nd2 Nd 0.14281 0.85719 0.92829 1.00000
Sm1 Sm 0.28539 0.71461 0.35803 1.00000
Sm2 Sm 0.71461 0.28539 0.64197 1.00000
Sm3 Sm 0.42868 0.57132 0.78485 1.00000
Sm4 Sm 0.57132 0.42868 0.21515 1.00000
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