Ac2Tb2Pm5
Alexandria ALEXAlex-ID: agm005565705 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_593_spg12
Tb5Pm3 Ac Pm
2023-06-03 05:58:33.701743
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005565705).
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
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# CIF generated by HEAS from Alexandria entry agm005565705
data_agm005565705
_cell_length_a 3.69037
_cell_length_b 12.43594
_cell_length_c 10.54306
_cell_angle_alpha 48.13389
_cell_angle_beta 100.21917
_cell_angle_gamma 81.76947
_cell_volume 331.26089
_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 0.71641 0.67681 0.11588 1.00000
Ac2 Ac 0.28359 0.32319 0.88412 1.00000
Tb1 Tb 0.85350 0.96995 0.67281 1.00000
Tb2 Tb 0.14650 0.03005 0.32719 1.00000
Pm1 Pm 0.84907 0.72020 0.43049 1.00000
Pm2 Pm 0.15093 0.27980 0.56951 1.00000
Pm3 Pm 0.56507 0.65227 0.78123 1.00000
Pm4 Pm 0.43493 0.34773 0.21877 1.00000
Pm5 Pm 0.00000 0.00000 0.00000 1.00000
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