Ac6RuRh2Au
Alexandria ALEXAlex-ID: agm004956554 · Space group: R3 (#146)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_266_spg146
Ac6Ru2Rh Ac12Ru3Au5 Ac3Rh2 Ru
2022-08-02 08:43:00.255259
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004956554).
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 agm004956554
data_agm004956554
_cell_length_a 7.53795
_cell_length_b 7.53715
_cell_length_c 8.21456
_cell_angle_alpha 62.65003
_cell_angle_beta 62.66711
_cell_angle_gamma 60.01802
_cell_volume 342.70680
_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 0.57711 0.26403 0.23995 1.00000
Ac2 Ac 0.26430 0.91836 0.23977 1.00000
Ac3 Ac 0.91902 0.57666 0.24030 1.00000
Ac4 Ac 0.39596 0.74257 0.75952 1.00000
Ac5 Ac 0.74184 0.10190 0.76016 1.00000
Ac6 Ac 0.10131 0.39646 0.76049 1.00000
Ru1 Ru 0.33292 0.33320 0.00116 1.00000
Rh1 Rh 0.50028 0.50033 0.49895 1.00000
Rh2 Rh 0.99662 0.99613 0.01073 1.00000
Au1 Au 0.83224 0.83197 0.50418 1.00000
Get direct link