SmDy2Bi3
Alexandria ALEXAlex-ID: agm034743841 · Space group: Fddd (#70)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_36_spg70
SmDy3Bi4 Sm3DyBi4
2025-02-26 03:34:02
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm034743841).
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 agm034743841
data_agm034743841
_cell_length_a 14.94002
_cell_length_b 14.24935
_cell_length_c 7.79129
_cell_angle_alpha 79.47897
_cell_angle_beta 69.67473
_cell_angle_gamma 30.84631
_cell_volume 774.09926
_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 0.91679 0.91679 0.08321 1.00000
Sm2 Sm 0.33321 0.33321 0.16679 1.00000
Sm3 Sm 0.16679 0.16679 0.33321 1.00000
Sm4 Sm 0.08321 0.08321 0.91679 1.00000
Dy1 Dy 0.00073 0.00073 0.49927 1.00000
Dy2 Dy 0.41604 0.41604 0.58396 1.00000
Dy3 Dy 0.83396 0.83396 0.66604 1.00000
Dy4 Dy 0.24927 0.24927 0.75073 1.00000
Dy5 Dy 0.75073 0.75073 0.24927 1.00000
Dy6 Dy 0.66604 0.66604 0.83396 1.00000
Dy7 Dy 0.58396 0.58396 0.41604 1.00000
Dy8 Dy 0.49927 0.49927 0.00073 1.00000
Bi1 Bi 0.66781 0.16710 0.82839 1.00000
Bi2 Bi 0.16710 0.66781 0.33670 1.00000
Bi3 Bi 0.58219 0.08290 0.42161 1.00000
Bi4 Bi 0.08290 0.58219 0.91330 1.00000
Bi5 Bi 0.50453 0.99547 0.99547 1.00000
Bi6 Bi 0.99547 0.50453 0.50453 1.00000
Bi7 Bi 0.91330 0.42161 0.08290 1.00000
Bi8 Bi 0.42161 0.91330 0.58219 1.00000
Bi9 Bi 0.33670 0.82839 0.16710 1.00000
Bi10 Bi 0.82839 0.33670 0.66781 1.00000
Bi11 Bi 0.74547 0.25453 0.25453 1.00000
Bi12 Bi 0.25453 0.74547 0.74547 1.00000
