Tm6Zn4Fe3NiSn
Alexandria ALEXAlex-ID: agm010595751 · Space group: P-6m2 (#187)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3D4E6_5_spg187
Tm2ZnNi2 TmZn TmFe2 TmZn2 Tm5Sn3
2024-07-09 09:08:25.367224
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010595751).
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 agm010595751
data_agm010595751
_cell_length_a 9.36584
_cell_length_b 9.36584
_cell_length_c 4.00665
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 120.00000
_cell_volume 304.37239
_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 0.68854 0.84427 0.00000 1.00000
Tm2 Tm 0.15573 0.84427 0.00000 1.00000
Tm3 Tm 0.15573 0.31146 0.00000 1.00000
Tm4 Tm 0.41549 0.20774 0.50000 1.00000
Tm5 Tm 0.79226 0.20774 0.50000 1.00000
Tm6 Tm 0.79226 0.58451 0.50000 1.00000
Zn1 Zn 0.33333 0.66667 0.00000 1.00000
Zn2 Zn 0.97003 0.48501 0.00000 1.00000
Zn3 Zn 0.51499 0.48501 0.00000 1.00000
Zn4 Zn 0.51499 0.02997 0.00000 1.00000
Fe1 Fe 0.15625 0.57812 0.50000 1.00000
Fe2 Fe 0.42188 0.57812 0.50000 1.00000
Fe3 Fe 0.42188 0.84375 0.50000 1.00000
Ni1 Ni 0.66667 0.33333 0.00000 1.00000
Sn1 Sn 0.00000 0.00000 0.50000 1.00000
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