Co3Rh(SO4)6
Alexandria ALEXAlex-ID: agm020940271 · Space group: R3 (#146)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C6D24_0_spg146
SO5 SO3 Rh(SO4)2 CoSO4
2024-12-04 00:22:01
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm020940271).
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 agm020940271
data_agm020940271
_cell_length_a 8.72307
_cell_length_b 8.72307
_cell_length_c 8.72307
_cell_angle_alpha 55.55994
_cell_angle_beta 55.55994
_cell_angle_gamma 55.55994
_cell_volume 420.97351
_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
Co1 Co 0.64443 0.64443 0.64443 1.00000
Co2 Co 0.35470 0.35470 0.35470 1.00000
Co3 Co 0.15374 0.15374 0.15374 1.00000
Rh1 Rh 0.84759 0.84759 0.84759 1.00000
S1 S 0.53430 0.25018 0.96422 1.00000
S2 S 0.74975 0.04684 0.45449 1.00000
S3 S 0.04684 0.45449 0.74975 1.00000
S4 S 0.96422 0.53430 0.25018 1.00000
S5 S 0.25018 0.96422 0.53430 1.00000
S6 S 0.45449 0.74975 0.04684 1.00000
O1 O 0.88895 0.47818 0.71086 1.00000
O2 O 0.47818 0.71086 0.88895 1.00000
O3 O 0.66783 0.03594 0.00709 1.00000
O4 O 0.33815 0.28674 0.97673 1.00000
O5 O 0.69995 0.03897 0.65504 1.00000
O6 O 0.01749 0.32458 0.96164 1.00000
O7 O 0.71086 0.88895 0.47818 1.00000
O8 O 0.62256 0.37691 0.76064 1.00000
O9 O 0.96164 0.01749 0.32458 1.00000
O10 O 0.24770 0.36371 0.61778 1.00000
O11 O 0.61778 0.24770 0.36371 1.00000
O12 O 0.03897 0.65504 0.69995 1.00000
O13 O 0.97673 0.33815 0.28674 1.00000
O14 O 0.37691 0.76064 0.62256 1.00000
O15 O 0.76064 0.62256 0.37691 1.00000
O16 O 0.03594 0.00709 0.66783 1.00000
O17 O 0.36371 0.61778 0.24770 1.00000
O18 O 0.31082 0.10685 0.51063 1.00000
O19 O 0.00709 0.66783 0.03594 1.00000
O20 O 0.28674 0.97673 0.33815 1.00000
O21 O 0.65504 0.69995 0.03897 1.00000
O22 O 0.32458 0.96164 0.01749 1.00000
O23 O 0.51063 0.31082 0.10685 1.00000
O24 O 0.10685 0.51063 0.31082 1.00000
