Ce6NiRh8
Alexandria ALEXAlex-ID: agm072990697 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_184_spg2
CeRh2 Ce2NiRh3 CeRh
2024-10-07 05:29:49.006382
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072990697).
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 agm072990697
data_agm072990697
_cell_length_a 5.53756
_cell_length_b 7.35949
_cell_length_c 8.47305
_cell_angle_alpha 83.91554
_cell_angle_beta 106.31760
_cell_angle_gamma 113.16195
_cell_volume 304.68233
_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
Ce1 Ce 0.96514 0.22731 0.56201 1.00000
Ce2 Ce 0.72529 0.25448 0.93563 1.00000
Ce3 Ce 0.61130 0.72662 0.74724 1.00000
Ce4 Ce 0.03486 0.77269 0.43799 1.00000
Ce5 Ce 0.27471 0.74552 0.06437 1.00000
Ce6 Ce 0.38870 0.27338 0.25276 1.00000
Ni1 Ni 0.00000 0.00000 0.00000 1.00000
Rh1 Rh 0.77805 0.99328 0.23551 1.00000
Rh2 Rh 0.22195 0.00672 0.76449 1.00000
Rh3 Rh 0.97473 0.40532 0.27069 1.00000
Rh4 Rh 0.48138 0.69695 0.43310 1.00000
Rh5 Rh 0.72955 0.65709 0.08107 1.00000
Rh6 Rh 0.02527 0.59468 0.72931 1.00000
Rh7 Rh 0.51862 0.30305 0.56690 1.00000
Rh8 Rh 0.27045 0.34291 0.91893 1.00000
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