RbTl2InHg
Alexandria ALEXAlex-ID: agm005004530 · Space group: Imm2 (#44)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD2_1563_spg119
RbTl3 Tl6In RbIn4 RbHg2
2022-07-05 01:45:56.466082
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005004530).
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 agm005004530
data_agm005004530
_cell_length_a 5.10171
_cell_length_b 5.17212
_cell_length_c 7.53394
_cell_angle_alpha 110.07530
_cell_angle_beta 109.79051
_cell_angle_gamma 90.00000
_cell_volume 174.16358
_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 0.43835 0.43835 0.87671 1.00000
Tl1 Tl 0.69702 0.19702 0.39404 1.00000
Tl2 Tl 0.05542 0.05542 0.11083 1.00000
In1 In 0.19508 0.69508 0.39015 1.00000
Hg1 Hg 0.82628 0.82628 0.65255 1.00000
