DyBi2Sb2Pt7
Alexandria ALEXAlex-ID: agm030690419 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D7_257_spg12
BiSbPt2 DyPt3
2025-03-02 02:46:39
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm030690419).
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 agm030690419
data_agm030690419
_cell_length_a 16.33381
_cell_length_b 16.33381
_cell_length_c 16.33381
_cell_angle_alpha 165.67951
_cell_angle_beta 165.67951
_cell_angle_gamma 20.30565
_cell_volume 266.57304
_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 0.00000 0.00000 0.00000 1.00000
Bi1 Bi 0.21257 0.21257 0.00000 1.00000
Bi2 Bi 0.78743 0.78743 0.00000 1.00000
Sb1 Sb 0.38115 0.38115 0.00000 1.00000
Sb2 Sb 0.61885 0.61885 0.00000 1.00000
Pt1 Pt 0.50000 0.50000 0.00000 1.00000
Pt2 Pt 0.70094 0.70094 0.00000 1.00000
Pt3 Pt 0.29906 0.29906 0.00000 1.00000
Pt4 Pt 0.56587 0.06587 0.50000 1.00000
Pt5 Pt 0.06587 0.56587 0.50000 1.00000
Pt6 Pt 0.93413 0.43413 0.50000 1.00000
Pt7 Pt 0.43413 0.93413 0.50000 1.00000
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