Pm3B8Os3
Alexandria ALEXAlex-ID: agm003376211 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B3C8_27_spg71
Pm5Os2 Pm(BOs)2 PmB4
2022-02-08 23:43:32.370274
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003376211).
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 agm003376211
data_agm003376211
_cell_length_a 3.12268
_cell_length_b 8.02881
_cell_length_c 8.02881
_cell_angle_alpha 73.56780
_cell_angle_beta 78.78641
_cell_angle_gamma 78.78641
_cell_volume 187.29396
_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
Pm1 Pm 0.50000 0.50000 0.50000 1.00000
Pm2 Pm 0.78208 0.21792 0.21792 1.00000
Pm3 Pm 0.21792 0.78208 0.78208 1.00000
B1 B 0.62960 0.13638 0.60442 1.00000
B2 B 0.37040 0.86362 0.39558 1.00000
B3 B 0.62960 0.60442 0.13638 1.00000
B4 B 0.37040 0.39558 0.86362 1.00000
B5 B 0.85020 0.82620 0.47341 1.00000
B6 B 0.14980 0.17380 0.52659 1.00000
B7 B 0.85020 0.47341 0.82620 1.00000
B8 B 0.14980 0.52659 0.17380 1.00000
Os1 Os 0.50000 0.00000 0.00000 1.00000
Os2 Os 0.00000 0.78260 0.21740 1.00000
Os3 Os 0.00000 0.21740 0.78260 1.00000
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