Ac3Tm2Zr3
Alexandria ALEXAlex-ID: agm010051692 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C3_16_spg71
TmZr5 Ac Tm
2024-07-14 18:44:56.280639
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010051692).
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 agm010051692
data_agm010051692
_cell_length_a 8.27162
_cell_length_b 8.27162
_cell_length_c 8.27162
_cell_angle_alpha 138.50734
_cell_angle_beta 137.69156
_cell_angle_gamma 60.75320
_cell_volume 249.66139
_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
Ac1 Ac 0.86112 0.86112 0.00000 1.00000
Ac2 Ac 0.00000 0.50000 0.50000 1.00000
Ac3 Ac 0.13888 0.13888 0.00000 1.00000
Tm1 Tm 0.25974 0.75974 0.50000 1.00000
Tm2 Tm 0.74026 0.24026 0.50000 1.00000
Zr1 Zr 0.38866 0.38866 0.00000 1.00000
Zr2 Zr 0.61134 0.61134 0.00000 1.00000
Zr3 Zr 0.50000 0.00000 0.50000 1.00000
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