Sr8GaAu2
Alexandria ALEXAlex-ID: agm005999549 · Space group: P-3m1 (#164)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_139_spg164
Sr8Ga7 Sr5Au2 Sr
2023-10-18 22:20:03.824129
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005999549).
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 agm005999549
data_agm005999549
_cell_length_a 6.49381
_cell_length_b 9.84380
_cell_length_c 9.83427
_cell_angle_alpha 120.03830
_cell_angle_beta 89.99116
_cell_angle_gamma 90.00071
_cell_volume 544.21056
_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
Sr1 Sr 0.25514 0.66658 0.33311 1.00000
Sr2 Sr 0.74486 0.33342 0.66686 1.00000
Sr3 Sr 0.74859 0.84212 0.15547 1.00000
Sr4 Sr 0.25150 0.15539 0.31350 1.00000
Sr5 Sr 0.25141 0.68662 0.84173 1.00000
Sr6 Sr 0.25141 0.15788 0.84452 1.00000
Sr7 Sr 0.74850 0.84461 0.68648 1.00000
Sr8 Sr 0.74859 0.31338 0.15826 1.00000
Au1 Au 0.24379 0.33347 0.66698 1.00000
Au2 Au 0.75621 0.66653 0.33300 1.00000
Ga1 Ga 0.00000 0.00000 0.99999 1.00000
Get direct link