Pr2CdOsO8
Alexandria ALEXAlex-ID: agm004900366 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_356_spg65
PrO2 Pr6OsO12 OsO4 CdO
2023-01-01 22:23:27.442251
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004900366).
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 agm004900366
data_agm004900366
_cell_length_a 4.93737
_cell_length_b 4.91484
_cell_length_c 7.50210
_cell_angle_alpha 87.92158
_cell_angle_beta 87.83704
_cell_angle_gamma 93.71702
_cell_volume 181.39938
_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
Pr1 Pr 0.45407 0.45136 0.74698 1.00000
Pr2 Pr 0.54593 0.54864 0.25302 1.00000
Cd1 Cd 0.00000 0.00000 0.50000 1.00000
Os1 Os 0.00000 0.00000 0.00000 1.00000
O1 O 0.13492 0.77659 0.18112 1.00000
O2 O 0.73083 0.72711 0.95996 1.00000
O3 O 0.77369 0.13561 0.17936 1.00000
O4 O 0.86508 0.22341 0.81888 1.00000
O5 O 0.26917 0.27289 0.04004 1.00000
O6 O 0.22631 0.86439 0.82064 1.00000
O7 O 0.69821 0.69908 0.52198 1.00000
O8 O 0.30179 0.30092 0.47802 1.00000
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