Pr2Nd(SmHo)2
Alexandria ALEXAlex-ID: agm011533232 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_491_spg2
PrNd3Ho4 Nd2SmHo6 PrSm4 Pr
2024-05-10 12:38:05.681572
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011533232).
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 agm011533232
data_agm011533232
_cell_length_a 8.71653
_cell_length_b 8.71653
_cell_length_c 8.97158
_cell_angle_alpha 61.20674
_cell_angle_beta 61.20674
_cell_angle_gamma 23.66339
_cell_volume 238.16590
_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 0.35618 0.35618 0.84149 1.00000
Pr2 Pr 0.64382 0.64382 0.15851 1.00000
Nd1 Nd 0.00000 0.00000 0.00000 1.00000
Sm1 Sm 0.93016 0.93016 0.42566 1.00000
Sm2 Sm 0.06984 0.06984 0.57434 1.00000
Ho1 Ho 0.29326 0.29326 0.29834 1.00000
Ho2 Ho 0.70674 0.70674 0.70166 1.00000
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