Rb5In2Au5
Alexandria ALEXAlex-ID: agm005654617 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_17_spg12
Rb3In2Au3 RbAu
2023-06-19 07:26:52.005006
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005654617).
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 agm005654617
data_agm005654617
_cell_length_a 4.69205
_cell_length_b 7.90498
_cell_length_c 12.79578
_cell_angle_alpha 96.73679
_cell_angle_beta 79.43545
_cell_angle_gamma 72.73583
_cell_volume 438.01995
_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 0.50000 0.50000 0.50000 1.00000
Rb2 Rb 0.34525 0.30785 0.00166 1.00000
Rb3 Rb 0.32394 0.08355 0.26857 1.00000
Rb4 Rb 0.67606 0.91645 0.73143 1.00000
Rb5 Rb 0.65475 0.69215 0.99834 1.00000
In1 In 0.96058 0.33973 0.73911 1.00000
In2 In 0.03942 0.66027 0.26089 1.00000
Au1 Au 0.81945 0.91056 0.45053 1.00000
Au2 Au 0.34262 0.53681 0.77795 1.00000
Au3 Au 0.65738 0.46319 0.22205 1.00000
Au4 Au 0.18055 0.08944 0.54947 1.00000
Au5 Au 0.00000 0.00000 0.00000 1.00000
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