La2(SmDy)5
Alexandria ALEXAlex-ID: agm005653117 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_18_spg12
Sm3Dy5 La3Sm5 SmDy5
2023-06-19 01:28:28.375986
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005653117).
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 agm005653117
data_agm005653117
_cell_length_a 5.10669
_cell_length_b 10.84862
_cell_length_c 8.08600
_cell_angle_alpha 98.51596
_cell_angle_beta 71.59250
_cell_angle_gamma 76.38708
_cell_volume 400.91347
_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
La1 La 0.33510 0.50022 0.82958 1.00000
La2 La 0.66490 0.49978 0.17042 1.00000
Sm1 Sm 0.67019 0.24563 0.41400 1.00000
Sm2 Sm 0.00297 0.24601 0.74804 1.00000
Sm3 Sm 0.99703 0.75399 0.25196 1.00000
Sm4 Sm 0.32981 0.75437 0.58600 1.00000
Sm5 Sm 0.00000 0.00000 0.00000 1.00000
Dy1 Dy 0.00000 0.50000 0.50000 1.00000
Dy2 Dy 0.66491 0.75380 0.91638 1.00000
Dy3 Dy 0.33406 0.99875 0.33313 1.00000
Dy4 Dy 0.66594 0.00125 0.66687 1.00000
Dy5 Dy 0.33509 0.24620 0.08362 1.00000
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