RbGa3Au
Alexandria ALEXAlex-ID: agm005779221 · Space group: I4mm (#107)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3_4_spg107
RbGaAu RbGa3 Rb(GaAu)4
2023-07-07 15:50:47.525605
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005779221).
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
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# CIF generated by HEAS from Alexandria entry agm005779221
data_agm005779221
_cell_length_a 4.66876
_cell_length_b 4.67066
_cell_length_c 6.41754
_cell_angle_alpha 68.70268
_cell_angle_beta 68.71197
_cell_angle_gamma 89.98518
_cell_volume 120.08452
_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 0.39929 0.20271 0.90661 1.00000
Ga1 Ga 0.65096 0.95451 0.40353 1.00000
Ga2 Ga 0.15092 0.45441 0.40355 1.00000
Ga3 Ga 0.77923 0.58277 0.14656 1.00000
Au1 Au 0.02737 0.83078 0.65088 1.00000
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