Na3(ZnSb)2
Alexandria ALEXAlex-ID: agm009653237 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_22_spg12
NaZn11 Na3Sb NaZnSb
2024-03-31 05:11:54
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009653237).
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 agm009653237
data_agm009653237
_cell_length_a 5.84747
_cell_length_b 5.84747
_cell_length_c 6.98702
_cell_angle_alpha 79.91071
_cell_angle_beta 79.91071
_cell_angle_gamma 49.12797
_cell_volume 177.27180
_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
Na1 Na 0.50000 0.50000 0.00000 1.00000
Na2 Na 0.65656 0.65656 0.39682 1.00000
Na3 Na 0.34344 0.34344 0.60318 1.00000
Zn1 Zn 0.80499 0.80499 0.96386 1.00000
Zn2 Zn 0.19501 0.19501 0.03614 1.00000
Sb1 Sb 0.96431 0.96431 0.30167 1.00000
Sb2 Sb 0.03569 0.03569 0.69833 1.00000
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