KSbAu
Alexandria ALEXAlex-ID: agm003607485 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_7381_spg63
KSb2 K2Sb2Au3 K3Sb2Au3
2022-03-07 07:47:01.678132
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003607485).
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 agm003607485
data_agm003607485
_cell_length_a 3.86564
_cell_length_b 7.17590
_cell_length_c 6.94054
_cell_angle_alpha 89.99838
_cell_angle_beta 73.79036
_cell_angle_gamma 90.00658
_cell_volume 184.87315
_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 0.65286 0.43101 0.70428 1.00000
K2 K 0.01969 0.93108 0.97155 1.00000
Sb1 Sb 0.91738 0.43096 0.17472 1.00000
Sb2 Sb 0.75383 0.93091 0.50102 1.00000
Au1 Au 0.33558 0.68089 0.33789 1.00000
Au2 Au 0.33556 0.18091 0.33787 1.00000
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