Sb4Au
Alexandria ALEXAlex-ID: agm005544934 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4_26_spg14
Sb2Au Sb
2023-05-29 02:00:58.644364
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005544934).
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 agm005544934
data_agm005544934
_cell_length_a 6.07188
_cell_length_b 6.09792
_cell_length_c 8.12079
_cell_angle_alpha 100.73711
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 295.41508
_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
Sb1 Sb 0.31131 0.20338 0.24917 1.00000
Sb2 Sb 0.81131 0.79662 0.25083 1.00000
Sb3 Sb 0.68869 0.79662 0.75083 1.00000
Sb4 Sb 0.18869 0.20338 0.74917 1.00000
Sb5 Sb 0.83003 0.36401 0.56299 1.00000
Sb6 Sb 0.33003 0.63599 0.93701 1.00000
Sb7 Sb 0.16997 0.63599 0.43701 1.00000
Sb8 Sb 0.66997 0.36401 0.06299 1.00000
Au1 Au 0.00000 0.00000 0.00000 1.00000
Au2 Au 0.50000 0.00000 0.50000 1.00000
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