MgSn
Alexandria ALEXAlex-ID: agm005453405 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB_1540_spg8
Mg2Sn Sn
2023-03-21 12:59:25.146401
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005453405).
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 agm005453405
data_agm005453405
_cell_length_a 6.17492
_cell_length_b 6.17492
_cell_length_c 7.79498
_cell_angle_alpha 75.99519
_cell_angle_beta 75.99519
_cell_angle_gamma 31.11934
_cell_volume 148.68385
_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 0.00204 0.00204 0.99572 1.00000
Mg2 Mg 0.33394 0.33394 0.34822 1.00000
Mg3 Mg 0.72551 0.72551 0.05837 1.00000
Sn1 Sn 0.38167 0.38167 0.74371 1.00000
Sn2 Sn 0.66159 0.66159 0.67020 1.00000
Sn3 Sn 0.06190 0.06190 0.35044 1.00000
