K8BiAu2O
Alexandria ALEXAlex-ID: agm004901909 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_765_spg10
K4O K3Bi K3AuO K5Au3
2023-01-06 16:37:43.272390
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004901909).
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 agm004901909
data_agm004901909
_cell_length_a 6.16599
_cell_length_b 7.81301
_cell_length_c 10.41980
_cell_angle_alpha 89.95374
_cell_angle_beta 90.00034
_cell_angle_gamma 100.85390
_cell_volume 492.99329
_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
K1 K 0.04864 0.77610 0.20448 1.00000
K2 K 0.61646 0.80095 0.99982 1.00000
K3 K 0.95081 0.22376 0.20432 1.00000
K4 K 0.95136 0.22390 0.79552 1.00000
K5 K 0.38354 0.19905 0.00018 1.00000
K6 K 0.04919 0.77624 0.79568 1.00000
K7 K 0.46290 0.74404 0.49996 1.00000
K8 K 0.53710 0.25596 0.50004 1.00000
Bi1 Bi 0.00000 0.00000 0.50000 1.00000
Au1 Au 0.50041 0.49989 0.77624 1.00000
Au2 Au 0.49959 0.50011 0.22376 1.00000
O1 O 0.00000 0.00000 0.00000 1.00000
Get direct link