Sc6OsRu2Rh3
Alexandria ALEXAlex-ID: agm028041884 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_242_spg12
Sc3RuRh2 Sc2RuRh ScOs2 Sc5Os3
2024-11-08 22:04:42.961328
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm028041884).
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 agm028041884
data_agm028041884
_cell_length_a 7.24618
_cell_length_b 7.24618
_cell_length_c 6.37290
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 143.27322
_cell_volume 200.10449
_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
Sc1 Sc 0.66662 0.33338 0.25486 1.00000
Sc2 Sc 0.33338 0.66662 0.25486 1.00000
Sc3 Sc 0.33338 0.66662 0.74514 1.00000
Sc4 Sc 0.00000 0.00000 0.25450 1.00000
Sc5 Sc 0.00000 0.00000 0.74550 1.00000
Sc6 Sc 0.66662 0.33338 0.74514 1.00000
Os1 Os 0.50000 0.50000 0.50000 1.00000
Ru1 Ru 0.16677 0.83323 0.50000 1.00000
Ru2 Ru 0.83323 0.16677 0.50000 1.00000
Rh1 Rh 0.50000 0.50000 0.00000 1.00000
Rh2 Rh 0.16689 0.83311 0.00000 1.00000
Rh3 Rh 0.83311 0.16689 0.00000 1.00000
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