Tm3(ZrIn)2
Alexandria ALEXAlex-ID: agm010060489 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_22_spg12
Zr3In Tm2In Zr
2024-07-14 17:01:06.663485
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010060489).
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 agm010060489
data_agm010060489
_cell_length_a 5.65172
_cell_length_b 5.65172
_cell_length_c 7.52707
_cell_angle_alpha 80.11040
_cell_angle_beta 80.11040
_cell_angle_gamma 48.41001
_cell_volume 176.60374
_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 0.85365 0.85365 0.44914 1.00000
Tm3 Tm 0.14635 0.14635 0.55086 1.00000
Zr1 Zr 0.44085 0.44085 0.71236 1.00000
Zr2 Zr 0.55915 0.55915 0.28764 1.00000
In1 In 0.71525 0.71525 0.85886 1.00000
In2 In 0.28475 0.28475 0.14114 1.00000
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