Pm3(ZnSn)4
Alexandria ALEXAlex-ID: agm005707946 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_0_spg71
Pm2Zn17 PmZnSn PmSn2
2023-06-29 23:50:33.283476
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005707946).
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 agm005707946
data_agm005707946
_cell_length_a 4.54162
_cell_length_b 4.26231
_cell_length_c 13.92435
_cell_angle_alpha 98.80389
_cell_angle_beta 99.38575
_cell_angle_gamma 89.99999
_cell_volume 262.71718
_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
Pm1 Pm 0.35478 0.85478 0.70956 1.00000
Pm2 Pm 0.64522 0.14522 0.29044 1.00000
Pm3 Pm 0.00000 0.00000 0.00000 1.00000
Zn1 Zn 0.25309 0.25309 0.50619 1.00000
Zn2 Zn 0.09528 0.59529 0.19057 1.00000
Zn3 Zn 0.90472 0.40471 0.80943 1.00000
Zn4 Zn 0.74691 0.74691 0.49381 1.00000
Sn1 Sn 0.80945 0.30946 0.61891 1.00000
Sn2 Sn 0.44855 0.44855 0.89709 1.00000
Sn3 Sn 0.55145 0.55145 0.10291 1.00000
Sn4 Sn 0.19055 0.69054 0.38109 1.00000
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