Cu6Si2Au
Alexandria ALEXAlex-ID: agm005716616 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_721_spg12
Cu15Si4 Si CuAu6
2023-07-12 22:50:40.089449
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005716616).
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 agm005716616
data_agm005716616
_cell_length_a 4.62312
_cell_length_b 4.62312
_cell_length_c 7.49042
_cell_angle_alpha 80.17052
_cell_angle_beta 80.17052
_cell_angle_gamma 50.26180
_cell_volume 120.89994
_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
Cu1 Cu 0.53271 0.53271 0.66591 1.00000
Cu2 Cu 0.14898 0.14898 0.43224 1.00000
Cu3 Cu 0.28693 0.28693 0.08991 1.00000
Cu4 Cu 0.85102 0.85102 0.56776 1.00000
Cu5 Cu 0.46729 0.46729 0.33409 1.00000
Cu6 Cu 0.71307 0.71307 0.91009 1.00000
Si1 Si 0.23070 0.23070 0.72572 1.00000
Si2 Si 0.76930 0.76930 0.27428 1.00000
Au1 Au 0.00000 0.00000 0.00000 1.00000
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