ZnAgSb
Alexandria ALEXAlex-ID: agm005683868 · Space group: Pmn2_1 (#31)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_24_spg129
Zn7Ag6 ZnAg2 Sb
2023-06-18 14:31:05.512706
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005683868).
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 agm005683868
data_agm005683868
_cell_length_a 4.36568
_cell_length_b 4.71215
_cell_length_c 6.60017
_cell_angle_alpha 89.99990
_cell_angle_beta 89.99905
_cell_angle_gamma 89.99999
_cell_volume 135.77718
_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 0.05556 0.95230 0.95373 1.00000
Zn2 Zn 0.55556 0.54770 0.45373 1.00000
Ag1 Ag 0.55557 0.06720 0.22343 1.00000
Ag2 Ag 0.05557 0.43280 0.72343 1.00000
Sb1 Sb 0.55556 0.55537 0.98949 1.00000
Sb2 Sb 0.05556 0.94463 0.48949 1.00000
