Rb2Ga3Sn5
Alexandria ALEXAlex-ID: agm005608758 · Space group: Ibam (#72)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C5_62_spg72
RbSn2 Rb(GaSn)2 Rb4Sn23
2023-06-24 09:47:36.157134
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005608758).
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 agm005608758
data_agm005608758
_cell_length_a 7.24216
_cell_length_b 9.90682
_cell_length_c 9.90682
_cell_angle_alpha 69.38519
_cell_angle_beta 68.56076
_cell_angle_gamma 68.56077
_cell_volume 595.91927
_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 0.12530 0.63075 0.11866 1.00000
Rb2 Rb 0.62530 0.11866 0.63075 1.00000
Rb3 Rb 0.87470 0.36925 0.88134 1.00000
Rb4 Rb 0.37470 0.88134 0.36925 1.00000
Ga1 Ga 0.37842 0.49589 0.74727 1.00000
Ga2 Ga 0.87842 0.74727 0.49589 1.00000
Ga3 Ga 0.62158 0.50411 0.25273 1.00000
Ga4 Ga 0.12158 0.25273 0.50411 1.00000
Ga5 Ga 0.25000 0.00000 0.00000 1.00000
Ga6 Ga 0.75000 0.00000 0.00000 1.00000
Sn1 Sn 0.38162 0.24525 0.99150 1.00000
Sn2 Sn 0.88162 0.99150 0.24525 1.00000
Sn3 Sn 0.61838 0.75475 0.00850 1.00000
Sn4 Sn 0.11838 0.00850 0.75475 1.00000
Sn5 Sn 0.50763 0.74237 0.74237 1.00000
Sn6 Sn 0.49237 0.25763 0.25763 1.00000
Sn7 Sn 0.75000 0.50000 0.50000 1.00000
Sn8 Sn 0.25000 0.50000 0.50000 1.00000
Sn9 Sn 0.99237 0.25763 0.25763 1.00000
Sn10 Sn 0.00763 0.74237 0.74237 1.00000
Get direct link