TmMn5
Alexandria ALEXAlex-ID: agm002289699 · Space group: I-4m2 (#119)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5_3_spg216
Tm2Mn17 Tm
2018-12-22 02:26:03
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002289699).
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 agm002289699
data_agm002289699
_cell_length_a 5.07901
_cell_length_b 4.92598
_cell_length_c 4.92377
_cell_angle_alpha 62.33438
_cell_angle_beta 58.94882
_cell_angle_gamma 58.94951
_cell_volume 87.05296
_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 0.00096 0.99895 0.99892 1.00000
Mn1 Mn 0.12675 0.62150 0.62174 1.00000
Mn2 Mn 0.61979 0.62815 0.13253 1.00000
Mn3 Mn 0.61930 0.13320 0.62815 1.00000
Mn4 Mn 0.63006 0.62173 0.62184 1.00000
Mn5 Mn 0.25316 0.24648 0.24682 1.00000
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