Tm5(MgMn)2
Alexandria ALEXAlex-ID: agm005564962 · Space group: Cmce (#64)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_258_spg64
Tm2Mg Tm Tm2Mn17
2023-06-02 23:33:00.232233
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005564962).
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 agm005564962
data_agm005564962
_cell_length_a 7.02532
_cell_length_b 7.09005
_cell_length_c 9.67327
_cell_angle_alpha 90.00000
_cell_angle_beta 68.70743
_cell_angle_gamma 90.00000
_cell_volume 448.93403
_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
Tm1 Tm 0.00000 0.00000 0.00000 1.00000
Tm2 Tm 0.50000 0.50000 0.00000 1.00000
Tm3 Tm 0.42660 0.18663 0.77166 1.00000
Tm4 Tm 0.80174 0.81337 0.77166 1.00000
Tm5 Tm 0.30174 0.68663 0.77166 1.00000
Tm6 Tm 0.92660 0.31337 0.77166 1.00000
Tm7 Tm 0.57340 0.81337 0.22834 1.00000
Tm8 Tm 0.19826 0.18663 0.22834 1.00000
Tm9 Tm 0.69826 0.31337 0.22834 1.00000
Tm10 Tm 0.07340 0.68663 0.22834 1.00000
Mg1 Mg 0.23449 0.00000 0.53103 1.00000
Mg2 Mg 0.73449 0.50000 0.53103 1.00000
Mg3 Mg 0.76551 0.00000 0.46897 1.00000
Mg4 Mg 0.26551 0.50000 0.46897 1.00000
Mn1 Mn 0.10216 0.39333 1.00000 1.00000
Mn2 Mn 0.89784 0.60667 0.00000 1.00000
Mn3 Mn 0.39784 0.89333 0.00000 1.00000
Mn4 Mn 0.60216 0.10667 1.00000 1.00000
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