Mg4InSn8
Alexandria ALEXAlex-ID: agm098109717 · Space group: Pm (#6)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1217_spg1
Sn In Mg2Sn
2025-06-22 02:30:58
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm098109717).
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 agm098109717
data_agm098109717
_cell_length_a 4.26057
_cell_length_b 7.66290
_cell_length_c 12.18364
_cell_angle_alpha 60.15894
_cell_angle_beta 90.01041
_cell_angle_gamma 90.00266
_cell_volume 345.03407
_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 0.07694 0.97989 0.14735 1.00000
Mg2 Mg 0.07727 0.68517 0.01410 1.00000
Mg3 Mg 0.07712 0.54435 0.44095 1.00000
Mg4 Mg 0.07719 0.81900 0.59009 1.00000
In1 In 0.57644 0.04500 0.92797 1.00000
Sn1 Sn 0.57687 0.32460 0.09527 1.00000
Sn2 Sn 0.57700 0.63036 0.22280 1.00000
Sn3 Sn 0.57687 0.46899 0.65302 1.00000
Sn4 Sn 0.57698 0.17900 0.53998 1.00000
Sn5 Sn 0.57695 0.89010 0.37137 1.00000
Sn6 Sn 0.07686 0.24657 0.32705 1.00000
Sn7 Sn 0.07666 0.41144 0.87244 1.00000
Sn8 Sn 0.57684 0.77553 0.79760 1.00000
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