Sm5(RhAu)2
Alexandria ALEXAlex-ID: agm005564705 · Space group: Cmce (#64)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_567_spg64
Sm2RhAu Sm5Rh3 SmAu
2023-06-03 06:26:18.878626
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005564705).
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 agm005564705
data_agm005564705
_cell_length_a 7.73547
_cell_length_b 7.63126
_cell_length_c 8.63293
_cell_angle_alpha 116.23065
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 457.13469
_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
Sm1 Sm 0.00000 0.00000 0.00000 1.00000
Sm2 Sm 0.50000 0.50000 0.00000 1.00000
Sm3 Sm 0.83027 0.80027 0.25959 1.00000
Sm4 Sm 0.16973 0.45932 0.25959 1.00000
Sm5 Sm 0.33027 0.95932 0.25959 1.00000
Sm6 Sm 0.66973 0.30027 0.25959 1.00000
Sm7 Sm 0.16973 0.19973 0.74041 1.00000
Sm8 Sm 0.83027 0.54068 0.74041 1.00000
Sm9 Sm 0.66973 0.04068 0.74041 1.00000
Sm10 Sm 0.33027 0.69973 0.74041 1.00000
Rh1 Rh 0.63172 0.86812 0.00000 1.00000
Rh2 Rh 0.36828 0.13188 1.00000 1.00000
Rh3 Rh 0.13172 0.63188 1.00000 1.00000
Rh4 Rh 0.86828 0.36812 0.00000 1.00000
Au1 Au 0.00000 0.20725 0.41451 1.00000
Au2 Au 0.50000 0.70725 0.41451 1.00000
Au3 Au 0.00000 0.79275 0.58549 1.00000
Au4 Au 0.50000 0.29275 0.58549 1.00000
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