RbSn2F8
Alexandria ALEXAlex-ID: agm005996533 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_1701_spg2
RbSnF5 SnF3
2023-10-17 02:06:59.335942
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005996533).
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 agm005996533
data_agm005996533
_cell_length_a 4.23787
_cell_length_b 7.86680
_cell_length_c 7.80758
_cell_angle_alpha 129.38063
_cell_angle_beta 98.02880
_cell_angle_gamma 92.51430
_cell_volume 196.21325
_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
Sn1 Sn 0.40033 0.41368 0.72510 1.00000
Sn2 Sn 0.59967 0.58632 0.27488 1.00000
Rb1 Rb 0.00000 0.00000 0.99999 1.00000
F1 F 0.09194 0.56560 0.24621 1.00000
F2 F 0.90806 0.43440 0.75376 1.00000
F3 F 0.55092 0.70275 0.09107 1.00000
F4 F 0.26417 0.11979 0.41733 1.00000
F5 F 0.38740 0.65594 0.70495 1.00000
F6 F 0.44908 0.29726 0.90891 1.00000
F7 F 0.73583 0.88020 0.58265 1.00000
F8 F 0.61260 0.34406 0.29504 1.00000
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