Ac5(PmIr2)2
Alexandria ALEXAlex-ID: agm005654852 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_603_spg12
Ac2Pm3Ir4 Pm5Ir3 Ac2Ir
2023-06-22 09:49:48.134571
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005654852).
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 agm005654852
data_agm005654852
_cell_length_a 4.32522
_cell_length_b 10.44817
_cell_length_c 9.14299
_cell_angle_alpha 122.19138
_cell_angle_beta 103.68193
_cell_angle_gamma 90.00000
_cell_volume 335.72562
_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 0.75312 0.16554 0.50623 1.00000
Ac2 Ac 0.24688 0.83446 0.49377 1.00000
Ac3 Ac 0.85440 0.63020 0.70879 1.00000
Ac4 Ac 0.50000 0.00000 0.00000 1.00000
Ac5 Ac 0.14560 0.36980 0.29121 1.00000
Pm1 Pm 0.54412 0.69451 0.08823 1.00000
Pm2 Pm 0.45588 0.30549 0.91177 1.00000
Ir1 Ir 0.33934 0.42175 0.67868 1.00000
Ir2 Ir 0.90689 0.09042 0.81378 1.00000
Ir3 Ir 0.66066 0.57825 0.32132 1.00000
Ir4 Ir 0.09311 0.90958 0.18622 1.00000
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