Rb4HgBi2
Alexandria ALEXAlex-ID: agm096600352 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_137_spg10
Rb4HgBi2
2025-04-11 12:04:58
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm096600352).
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 agm096600352
data_agm096600352
_cell_length_a 5.44452
_cell_length_b 6.79372
_cell_length_c 9.18628
_cell_angle_alpha 98.25374
_cell_angle_beta 88.17063
_cell_angle_gamma 98.49196
_cell_volume 332.56131
_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 0.23147 0.53288 0.17174 1.00000
Rb2 Rb 0.61812 0.94622 0.69556 1.00000
Rb3 Rb 0.08754 0.01086 0.37371 1.00000
Rb4 Rb 0.13553 0.46333 0.73158 1.00000
Hg1 Hg 0.63957 0.14182 0.12587 1.00000
Bi1 Bi 0.12044 0.00516 0.96831 1.00000
Bi2 Bi 0.66733 0.39972 0.43323 1.00000
