Tm3(ThZn)2
Alexandria ALEXAlex-ID: agm010103232 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_21_spg12
Tm2Th Th TmZn
2024-07-14 14:10:47.184548
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010103232).
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 agm010103232
data_agm010103232
_cell_length_a 8.28803
_cell_length_b 8.28803
_cell_length_c 8.28803
_cell_angle_alpha 37.31258
_cell_angle_beta 37.31258
_cell_angle_gamma 37.31258
_cell_volume 187.53973
_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 0.50000 0.50000 0.50000 1.00000
Tm2 Tm 0.34473 0.34473 0.34473 1.00000
Tm3 Tm 0.65527 0.65527 0.65527 1.00000
Th1 Th 0.07902 0.07902 0.07902 1.00000
Th2 Th 0.92098 0.92098 0.92098 1.00000
Zn1 Zn 0.21597 0.21597 0.21597 1.00000
Zn2 Zn 0.78403 0.78403 0.78403 1.00000
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