Mg3Sn2Bi3
Alexandria ALEXAlex-ID: agm009223129 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C3_1763_spg12
Bi Sn Mg3Bi2
2024-03-17 12:56:52.304130
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009223129).
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 agm009223129
data_agm009223129
_cell_length_a 11.68196
_cell_length_b 11.68196
_cell_length_c 10.35822
_cell_angle_alpha 58.94403
_cell_angle_beta 58.94403
_cell_angle_gamma 22.65898
_cell_volume 463.10610
_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
Mg1 Mg 0.33201 0.33201 0.10799 1.00000
Mg2 Mg 0.69447 0.69447 0.27855 1.00000
Mg3 Mg 0.30553 0.30553 0.72145 1.00000
Mg4 Mg 0.66799 0.66799 0.89201 1.00000
Mg5 Mg 0.62536 0.62536 0.64415 1.00000
Mg6 Mg 0.37464 0.37464 0.35585 1.00000
Sn1 Sn 0.22254 0.22254 0.43856 1.00000
Sn2 Sn 0.80901 0.80901 0.92834 1.00000
Sn3 Sn 0.19099 0.19099 0.07166 1.00000
Sn4 Sn 0.77746 0.77746 0.56144 1.00000
Bi1 Bi 0.07712 0.07712 0.87271 1.00000
Bi2 Bi 0.95233 0.95233 0.40576 1.00000
Bi3 Bi 0.04767 0.04767 0.59424 1.00000
Bi4 Bi 0.92288 0.92288 0.12729 1.00000
Bi5 Bi 0.42940 0.42940 0.76292 1.00000
Bi6 Bi 0.57060 0.57060 0.23708 1.00000
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