ZnGa2Cu7Sb2
Alexandria ALEXAlex-ID: agm004592736 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D7_153_spg12
Zn8Cu5 GaSb Cu
2022-06-25 11:05:26.797467
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004592736).
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 agm004592736
data_agm004592736
_cell_length_a 3.69926
_cell_length_b 3.69926
_cell_length_c 14.00404
_cell_angle_alpha 84.35233
_cell_angle_beta 84.35233
_cell_angle_gamma 89.69246
_cell_volume 189.78090
_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
Zn1 Zn 0.00000 0.00000 0.00000 1.00000
Ga1 Ga 0.60510 0.60510 0.73814 1.00000
Ga2 Ga 0.39490 0.39490 0.26186 1.00000
Cu1 Cu 0.50000 0.50000 0.00000 1.00000
Cu2 Cu 0.31492 0.31492 0.44526 1.00000
Cu3 Cu 0.68508 0.68508 0.55474 1.00000
Cu4 Cu 0.94951 0.45015 0.13264 1.00000
Cu5 Cu 0.45015 0.94951 0.13264 1.00000
Cu6 Cu 0.54985 0.05049 0.86736 1.00000
Cu7 Cu 0.05049 0.54985 0.86736 1.00000
Sb1 Sb 0.84254 0.84254 0.36877 1.00000
Sb2 Sb 0.15746 0.15746 0.63123 1.00000
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