In2GaSb2Au7
Alexandria ALEXAlex-ID: agm004593239 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D7_158_spg139
InAu7 InSbAu2 GaAu2 Sb2Au
2022-06-25 12:26:40.846724
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004593239).
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 agm004593239
data_agm004593239
_cell_length_a 4.11924
_cell_length_b 4.11924
_cell_length_c 16.75215
_cell_angle_alpha 78.80455
_cell_angle_beta 78.80455
_cell_angle_gamma 87.23070
_cell_volume 273.52142
_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
In1 In 0.68377 0.68377 0.74557 1.00000
In2 In 0.31623 0.31623 0.25443 1.00000
Ga1 Ga 0.00000 0.00000 0.00000 1.00000
Sb1 Sb 0.68965 0.68965 0.42178 1.00000
Sb2 Sb 0.31035 0.31035 0.57822 1.00000
Au1 Au 0.50000 0.50000 0.00000 1.00000
Au2 Au 0.18642 0.18642 0.42153 1.00000
Au3 Au 0.81358 0.81358 0.57847 1.00000
Au4 Au 0.90582 0.40586 0.13310 1.00000
Au5 Au 0.40586 0.90582 0.13310 1.00000
Au6 Au 0.59414 0.09418 0.86690 1.00000
Au7 Au 0.09418 0.59414 0.86690 1.00000
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