GaCuSn
Alexandria ALEXAlex-ID: agm003061237 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_222_spg69
Ga4Cu9 Ga2Cu Sn
2015-04-29 17:30:10
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003061237).
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
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# CIF generated by HEAS from Alexandria entry agm003061237
data_agm003061237
_cell_length_a 5.25620
_cell_length_b 5.37451
_cell_length_c 5.25614
_cell_angle_alpha 103.98011
_cell_angle_beta 59.91572
_cell_angle_gamma 76.02243
_cell_volume 112.44772
_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
Ga1 Ga 0.96033 0.51354 0.24168 1.00000
Ga2 Ga 0.28026 0.51351 0.56170 1.00000
Cu1 Cu 0.37018 0.01353 0.65154 1.00000
Cu2 Cu 0.87025 0.01370 0.15177 1.00000
Sn1 Sn 0.46231 0.82873 0.05953 1.00000
Sn2 Sn 0.77810 0.19839 0.74374 1.00000
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