La2(PrDy)5
Alexandria ALEXAlex-ID: agm005648664 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_18_spg12
La3Pr5 PrDy5 Pr
2023-06-19 01:24:35.250349
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005648664).
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 agm005648664
data_agm005648664
_cell_length_a 5.14009
_cell_length_b 8.19018
_cell_length_c 10.94914
_cell_angle_alpha 72.77220
_cell_angle_beta 76.42454
_cell_angle_gamma 71.71188
_cell_volume 412.88155
_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 0.91742 0.41367 0.75149 1.00000
La2 La 0.08258 0.58633 0.24851 1.00000
Pr1 Pr 0.83460 0.83139 0.49941 1.00000
Pr2 Pr 0.24796 0.75114 0.75293 1.00000
Pr3 Pr 0.75204 0.24886 0.24707 1.00000
Pr4 Pr 0.16540 0.16861 0.50059 1.00000
Pr5 Pr 0.00000 0.00000 0.00000 1.00000
Dy1 Dy 0.50000 0.50000 0.50000 1.00000
Dy2 Dy 0.33326 0.33273 0.00074 1.00000
Dy3 Dy 0.41668 0.91767 0.24898 1.00000
Dy4 Dy 0.58332 0.08233 0.75102 1.00000
Dy5 Dy 0.66674 0.66727 0.99926 1.00000
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