Sm3Dy2Tl
Alexandria ALEXAlex-ID: agm005665703 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_57_spg65
Sm3Dy5 Sm5Tl3 Sm
2023-08-25 00:35:29.356076
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005665703).
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 agm005665703
data_agm005665703
_cell_length_a 4.90911
_cell_length_b 4.93890
_cell_length_c 8.02502
_cell_angle_alpha 107.92180
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 185.13041
_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
Sm1 Sm 0.50000 0.16927 0.33854 1.00000
Sm2 Sm 0.50000 0.50000 0.00000 1.00000
Sm3 Sm 0.50000 0.83073 0.66146 1.00000
Dy1 Dy 0.00000 0.66279 0.32559 1.00000
Dy2 Dy 0.00000 0.33721 0.67441 1.00000
Tl1 Tl 0.00000 0.00000 0.00000 1.00000
