Dy3Bi2Sb
Alexandria ALEXAlex-ID: agm040218052 · Space group: Fddd (#70)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_36_spg70
Dy3Bi2Sb
2025-02-28 19:14:12
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm040218052).
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 agm040218052
data_agm040218052
_cell_length_a 14.73726
_cell_length_b 14.05566
_cell_length_c 7.68886
_cell_angle_alpha 79.47189
_cell_angle_beta 69.66783
_cell_angle_gamma 30.86028
_cell_volume 743.62562
_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
Dy1 Dy 0.66550 0.16584 0.83887 1.00000
Dy2 Dy 0.16584 0.66550 0.32979 1.00000
Dy3 Dy 0.58450 0.08416 0.41113 1.00000
Dy4 Dy 0.08416 0.58450 0.92021 1.00000
Dy5 Dy 0.49478 0.00522 0.00522 1.00000
Dy6 Dy 0.00522 0.49478 0.49478 1.00000
Dy7 Dy 0.92021 0.41113 0.08416 1.00000
Dy8 Dy 0.41113 0.92021 0.58450 1.00000
Dy9 Dy 0.32979 0.83887 0.16584 1.00000
Dy10 Dy 0.83887 0.32979 0.66550 1.00000
Dy11 Dy 0.75522 0.24478 0.24478 1.00000
Dy12 Dy 0.24478 0.75522 0.75522 1.00000
Bi1 Bi 0.99955 0.99955 0.50045 1.00000
Bi2 Bi 0.41726 0.41726 0.58274 1.00000
Bi3 Bi 0.83274 0.83274 0.66726 1.00000
Bi4 Bi 0.25045 0.25045 0.74955 1.00000
Bi5 Bi 0.74955 0.74955 0.25045 1.00000
Bi6 Bi 0.66726 0.66726 0.83274 1.00000
Bi7 Bi 0.58274 0.58274 0.41726 1.00000
Bi8 Bi 0.50045 0.50045 0.99955 1.00000
Sb1 Sb 0.91666 0.91666 0.08334 1.00000
Sb2 Sb 0.33334 0.33334 0.16666 1.00000
Sb3 Sb 0.16666 0.16666 0.33334 1.00000
Sb4 Sb 0.08334 0.08334 0.91666 1.00000
