Os3(Ru2Rh)2
Alexandria ALEXAlex-ID: agm005664643 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_842_spg2
OsRu2 RuRh Os2Ru
2023-06-28 03:13:15.044454
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005664643).
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 agm005664643
data_agm005664643
_cell_length_a 4.74194
_cell_length_b 8.43695
_cell_length_c 6.98279
_cell_angle_alpha 71.52478
_cell_angle_beta 89.95918
_cell_angle_gamma 73.76668
_cell_volume 253.21473
_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
Os1 Os 0.11244 0.94123 0.69618 1.00000
Os2 Os 0.44336 0.27755 0.02959 1.00000
Os3 Os 0.88756 0.05877 0.30382 1.00000
Os4 Os 0.55664 0.72245 0.97041 1.00000
Os5 Os 0.22209 0.38553 0.64379 1.00000
Os6 Os 0.77791 0.61447 0.35621 1.00000
Ru1 Ru 0.55619 0.05461 0.80702 1.00000
Ru2 Ru 0.00165 0.16300 0.92002 1.00000
Ru3 Ru 0.44381 0.94539 0.19298 1.00000
Ru4 Ru 0.99835 0.83700 0.07998 1.00000
Ru5 Ru 0.66737 0.83554 0.58117 1.00000
Ru6 Ru 0.89030 0.38853 0.13890 1.00000
Ru7 Ru 0.33263 0.16446 0.41883 1.00000
Ru8 Ru 0.10970 0.61147 0.86110 1.00000
Rh1 Rh 0.22080 0.72315 0.47104 1.00000
Rh2 Rh 0.33247 0.50122 0.24933 1.00000
Rh3 Rh 0.77920 0.27685 0.52896 1.00000
Rh4 Rh 0.66753 0.49878 0.75067 1.00000
Get direct link