AlZn17In11
Alexandria ALEXAlex-ID: agm008656720 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB11C17_92_spg8
Al3Zn4 Zn In
2024-06-24 11:53:59.847898
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm008656720).
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 agm008656720
data_agm008656720
_cell_length_a 9.19545
_cell_length_b 9.19545
_cell_length_c 7.44299
_cell_angle_alpha 79.29289
_cell_angle_beta 79.29289
_cell_angle_gamma 89.30843
_cell_volume 607.46333
_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
Al1 Al 0.76828 0.76828 0.82140 1.00000
Zn1 Zn 0.40938 0.40938 0.57942 1.00000
Zn2 Zn 0.58374 0.58374 0.70202 1.00000
Zn3 Zn 0.89514 0.89514 0.46259 1.00000
Zn4 Zn 0.27133 0.27133 0.36724 1.00000
Zn5 Zn 0.86242 0.86242 0.11581 1.00000
Zn6 Zn 0.46632 0.81828 0.83637 1.00000
Zn7 Zn 0.68607 0.03162 0.64253 1.00000
Zn8 Zn 0.18697 0.52907 0.43213 1.00000
Zn9 Zn 0.62676 0.97870 0.00876 1.00000
Zn10 Zn 0.04029 0.37297 0.23078 1.00000
Zn11 Zn 0.31732 0.66913 0.64213 1.00000
Zn12 Zn 0.66913 0.31732 0.64213 1.00000
Zn13 Zn 0.37297 0.04029 0.23078 1.00000
Zn14 Zn 0.97870 0.62676 0.00876 1.00000
Zn15 Zn 0.52907 0.18697 0.43213 1.00000
Zn16 Zn 0.03162 0.68607 0.64253 1.00000
Zn17 Zn 0.81828 0.46632 0.83637 1.00000
In1 In 0.59098 0.59098 0.19626 1.00000
In2 In 0.30196 0.55295 0.03647 1.00000
In3 In 0.95657 0.19437 0.59893 1.00000
In4 In 0.57174 0.85779 0.41268 1.00000
In5 In 0.83566 0.16213 0.18926 1.00000
In6 In 0.11014 0.35198 0.84754 1.00000
In7 In 0.35198 0.11014 0.84754 1.00000
In8 In 0.16213 0.83566 0.18926 1.00000
In9 In 0.85779 0.57174 0.41268 1.00000
In10 In 0.19437 0.95657 0.59893 1.00000
In11 In 0.55295 0.30196 0.03647 1.00000
