Rb5Cd2Hg5
Alexandria ALEXAlex-ID: agm005651145 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_19_spg12
Rb3Hg5 Rb3Cd16 RbHg
2023-06-19 06:20:09.097258
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005651145).
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 agm005651145
data_agm005651145
_cell_length_a 4.90067
_cell_length_b 9.70236
_cell_length_c 11.48966
_cell_angle_alpha 83.70448
_cell_angle_beta 77.68627
_cell_angle_gamma 75.37153
_cell_volume 515.54052
_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
Rb1 Rb 0.00000 0.50000 0.50000 1.00000
Rb2 Rb 0.69103 0.70395 0.91398 1.00000
Rb3 Rb 0.37288 0.92937 0.32487 1.00000
Rb4 Rb 0.62712 0.07063 0.67513 1.00000
Rb5 Rb 0.30897 0.29605 0.08602 1.00000
Cd1 Cd 0.39056 0.46030 0.75857 1.00000
Cd2 Cd 0.60944 0.53970 0.24143 1.00000
Hg1 Hg 0.70220 0.23955 0.35606 1.00000
Hg2 Hg 0.93556 0.29100 0.83788 1.00000
Hg3 Hg 0.06444 0.70900 0.16212 1.00000
Hg4 Hg 0.29780 0.76045 0.64394 1.00000
Hg5 Hg 0.00000 0.00000 0.00000 1.00000
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