LaSi2Au3
Alexandria ALEXAlex-ID: agm005669704 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_897_spg12
La(SiAu2)2 La(SiAu)2
2023-08-24 23:29:04.634829
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005669704).
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 agm005669704
data_agm005669704
_cell_length_a 4.34551
_cell_length_b 8.67195
_cell_length_c 8.28879
_cell_angle_alpha 53.28547
_cell_angle_beta 74.80341
_cell_angle_gamma 75.48995
_cell_volume 239.85117
_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
La1 La 0.84866 0.07359 0.22909 1.00000
La2 La 0.15134 0.92641 0.77091 1.00000
Si1 Si 0.48617 0.16423 0.86343 1.00000
Si2 Si 0.51383 0.83577 0.13657 1.00000
Si3 Si 0.81151 0.68647 0.69051 1.00000
Si4 Si 0.18849 0.31353 0.30949 1.00000
Au1 Au 0.31759 0.41275 0.95208 1.00000
Au2 Au 0.95916 0.35941 0.72226 1.00000
Au3 Au 0.61682 0.27253 0.49383 1.00000
Au4 Au 0.38318 0.72747 0.50617 1.00000
Au5 Au 0.04084 0.64059 0.27774 1.00000
Au6 Au 0.68241 0.58725 0.04792 1.00000
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