Zn6Ga5Ag
Alexandria ALEXAlex-ID: agm003677091 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_95_spg12
Zn15Ag Zn2Ga7 Ga4Ag3
2022-04-10 05:39:19.900293
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003677091).
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 agm003677091
data_agm003677091
_cell_length_a 7.14137
_cell_length_b 5.09457
_cell_length_c 7.85671
_cell_angle_alpha 71.08181
_cell_angle_beta 77.89122
_cell_angle_gamma 49.68434
_cell_volume 206.18049
_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 0.74930 0.08566 0.33132 1.00000
Zn2 Zn 0.25070 0.58302 0.33132 1.00000
Zn3 Zn 0.24866 0.25268 0.00000 1.00000
Zn4 Zn 0.75134 0.74732 1.00000 1.00000
Zn5 Zn 0.74930 0.41698 0.66868 1.00000
Zn6 Zn 0.25070 0.91434 0.66868 1.00000
Ga1 Ga 0.50000 0.16891 0.66218 1.00000
Ga2 Ga 0.00000 0.33168 0.33664 1.00000
Ga3 Ga 0.50000 0.50000 0.00000 1.00000
Ga4 Ga 1.00000 0.66832 0.66336 1.00000
Ga5 Ga 0.50000 0.83109 0.33782 1.00000
Ag1 Ag 0.00000 0.00000 0.00000 1.00000
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