Tb7TmMg4
Alexandria ALEXAlex-ID: agm003668877 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_86_spg12
TbTmMg Tb2Mg
2022-04-20 10:55:37.142594
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003668877).
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 agm003668877
data_agm003668877
_cell_length_a 5.74356
_cell_length_b 9.06105
_cell_length_c 8.07423
_cell_angle_alpha 68.29145
_cell_angle_beta 69.16532
_cell_angle_gamma 71.52220
_cell_volume 356.46243
_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
Tb1 Tb 0.79962 0.87767 0.52308 1.00000
Tb2 Tb 0.20038 0.12233 0.47692 1.00000
Tb3 Tb 0.08007 0.57585 0.26400 1.00000
Tb4 Tb 0.91993 0.42415 0.73600 1.00000
Tb5 Tb 0.25031 0.71285 0.78653 1.00000
Tb6 Tb 0.50000 0.00000 0.00000 1.00000
Tb7 Tb 0.74969 0.28715 0.21347 1.00000
Tm1 Tm 0.00000 0.00000 0.00000 1.00000
Mg1 Mg 0.54152 0.30265 0.61430 1.00000
Mg2 Mg 0.45848 0.69735 0.38570 1.00000
Mg3 Mg 0.67485 0.65430 0.99600 1.00000
Mg4 Mg 0.32515 0.34570 0.00400 1.00000
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