ZnCd4Ga
Alexandria ALEXAlex-ID: agm005872893 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_1927_spg1
Zn Cd Zn2Ga7
2023-07-31 16:24:39.587366
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005872893).
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 agm005872893
data_agm005872893
_cell_length_a 3.07185
_cell_length_b 6.72688
_cell_length_c 8.35336
_cell_angle_alpha 125.48909
_cell_angle_beta 79.40479
_cell_angle_gamma 76.80143
_cell_volume 125.46032
_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
Cd1 Cd 0.82714 0.51489 0.83082 1.00000
Cd2 Cd 0.33575 0.00274 0.32576 1.00000
Cd3 Cd 0.17286 0.48511 0.16918 1.00000
Cd4 Cd 0.66425 0.99726 0.67424 1.00000
Ga1 Ga 0.50000 0.50000 0.50000 1.00000
Get direct link