Sm4Dy9Tl11
Alexandria ALEXAlex-ID: agm005740902 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A4B9C11_8_spg65
Sm2Dy3Tl4 Dy5Tl4 SmTl
2023-07-11 08:09:16.129718
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005740902).
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 agm005740902
data_agm005740902
_cell_length_a 3.58437
_cell_length_b 14.14350
_cell_length_c 14.14350
_cell_angle_alpha 109.84312
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 674.44089
_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 0.58659 0.74955 1.00000
Sm2 Sm 0.50000 0.41341 0.25045 1.00000
Sm3 Sm 0.50000 0.74955 0.58659 1.00000
Sm4 Sm 0.50000 0.25045 0.41341 1.00000
Dy1 Dy 0.50000 0.61315 0.15973 1.00000
Dy2 Dy 0.50000 0.38685 0.84027 1.00000
Dy3 Dy 0.50000 0.15973 0.61315 1.00000
Dy4 Dy 0.50000 0.84027 0.38685 1.00000
Dy5 Dy 0.50000 0.79685 0.98588 1.00000
Dy6 Dy 0.50000 0.20315 0.01412 1.00000
Dy7 Dy 0.50000 0.98588 0.79685 1.00000
Dy8 Dy 0.50000 0.01412 0.20315 1.00000
Dy9 Dy 0.50000 0.50000 0.50000 1.00000
Tl1 Tl 0.00000 0.59069 0.95287 1.00000
Tl2 Tl 0.00000 0.40931 0.04713 1.00000
Tl3 Tl 0.00000 0.95287 0.59069 1.00000
Tl4 Tl 0.00000 0.04713 0.40931 1.00000
Tl5 Tl 0.00000 0.62379 0.37621 1.00000
Tl6 Tl 0.00000 0.37621 0.62379 1.00000
Tl7 Tl 0.00000 0.81273 0.18727 1.00000
Tl8 Tl 0.00000 0.18727 0.81273 1.00000
Tl9 Tl 0.00000 0.00000 0.00000 1.00000
Tl10 Tl 0.00000 0.79202 0.79202 1.00000
Tl11 Tl 0.00000 0.20798 0.20798 1.00000
