Rb2In3Ga
Alexandria ALEXAlex-ID: agm003418708 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_1174_spg15
RbIn4 Rb8In11 RbGa3
2022-02-13 05:22:40.675221
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003418708).
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 agm003418708
data_agm003418708
_cell_length_a 6.81800
_cell_length_b 7.48864
_cell_length_c 8.93223
_cell_angle_alpha 102.04629
_cell_angle_beta 112.43604
_cell_angle_gamma 90.00000
_cell_volume 410.65101
_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 0.68792 0.59488 0.37736 1.00000
Rb2 Rb 0.68944 0.09488 0.37736 1.00000
Rb3 Rb 0.31056 0.90512 0.62264 1.00000
Rb4 Rb 0.31208 0.40512 0.62264 1.00000
In1 In 0.29540 0.25000 1.00000 1.00000
In2 In 0.70460 0.75000 0.00000 1.00000
In3 In 0.10070 0.04929 0.20048 1.00000
In4 In 0.90022 0.45071 0.79952 1.00000
In5 In 0.09978 0.54929 0.20048 1.00000
In6 In 0.89930 0.95071 0.79952 1.00000
Ga1 Ga 0.26121 0.75000 0.00000 1.00000
Ga2 Ga 0.73879 0.25000 1.00000 1.00000
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