RbUHgF6
Alexandria ALEXAlex-ID: agm005097232 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD6_307_spg156
RbUF6 Hg
2022-12-15 13:08:40.241030
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005097232).
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 agm005097232
data_agm005097232
_cell_length_a 6.75709
_cell_length_b 6.71788
_cell_length_c 5.61708
_cell_angle_alpha 85.18464
_cell_angle_beta 87.00750
_cell_angle_gamma 58.58351
_cell_volume 216.81951
_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 0.98657 0.96144 0.00259 1.00000
U1 U 0.33414 0.34016 0.45922 1.00000
Hg1 Hg 0.67948 0.62152 0.81599 1.00000
F1 F 0.01559 0.54210 0.28839 1.00000
F2 F 0.22536 0.11984 0.62166 1.00000
F3 F 0.66711 0.14490 0.60892 1.00000
F4 F 0.20500 0.55481 0.74669 1.00000
F5 F 0.40926 0.58157 0.28909 1.00000
F6 F 0.47726 0.13372 0.16735 1.00000
Get direct link