LiSmDy
Alexandria ALEXAlex-ID: agm005686774 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_10959_spg12
Sm3Dy5 Li Sm
2023-06-19 12:21:25.198332
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005686774).
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 agm005686774
data_agm005686774
_cell_length_a 3.52543
_cell_length_b 3.52543
_cell_length_c 28.62532
_cell_angle_alpha 105.41208
_cell_angle_beta 105.41208
_cell_angle_gamma 59.96814
_cell_volume 293.15396
_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
Li1 Li 0.89238 0.89238 0.54011 1.00000
Li2 Li 0.10762 0.10762 0.45989 1.00000
Sm1 Sm 0.75171 0.75171 0.94286 1.00000
Sm2 Sm 0.24829 0.24829 0.05714 1.00000
Dy1 Dy 0.27079 0.27079 0.84005 1.00000
Dy2 Dy 0.72921 0.72921 0.15995 1.00000
