Sr(MgTl2)2
Alexandria ALEXAlex-ID: agm024016065 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_438_spg2
Sr(MgTl)6 SrMgTl3 SrMg2Tl5
2025-06-24 18:28:01
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024016065).
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 agm024016065
data_agm024016065
_cell_length_a 6.03250
_cell_length_b 6.03250
_cell_length_c 8.47402
_cell_angle_alpha 87.48824
_cell_angle_beta 92.51176
_cell_angle_gamma 139.35511
_cell_volume 200.64896
_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
Sr1 Sr 0.00000 0.00000 0.50000 1.00000
Mg1 Mg 0.85447 0.14553 0.05991 1.00000
Mg2 Mg 0.14553 0.85447 0.94009 1.00000
Tl1 Tl 0.28011 0.71989 0.32301 1.00000
Tl2 Tl 0.71989 0.28011 0.67699 1.00000
Tl3 Tl 0.43317 0.56683 0.81602 1.00000
Tl4 Tl 0.56683 0.43317 0.18398 1.00000
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