Na2ZnSn3
Alexandria ALEXAlex-ID: agm005682622 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_139_spg8
NaZn11 Na5(ZnSn5)2 NaSn
2023-08-22 21:06:58.209171
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005682622).
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 agm005682622
data_agm005682622
_cell_length_a 4.96100
_cell_length_b 6.28697
_cell_length_c 6.14729
_cell_angle_alpha 79.05588
_cell_angle_beta 66.20214
_cell_angle_gamma 66.76234
_cell_volume 161.09130
_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 0.55866 0.18156 0.70112 1.00000
Na2 Na 0.43152 0.81966 0.31729 1.00000
Zn1 Zn 0.17253 0.39939 0.25555 1.00000
Sn1 Sn 0.85825 0.58960 0.69390 1.00000
Sn2 Sn 0.82491 0.24077 0.10941 1.00000
Sn3 Sn 0.15412 0.76902 0.92274 1.00000
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