Cs2RbGe2Br7
Alexandria ALEXAlex-ID: agm004589986 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D7_13_spg12
CsGeBr3 RbBr
2022-06-26 11:48:17.911163
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004589986).
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 agm004589986
data_agm004589986
_cell_length_a 5.65767
_cell_length_b 5.65767
_cell_length_c 15.08967
_cell_angle_alpha 79.50458
_cell_angle_beta 79.50458
_cell_angle_gamma 89.17420
_cell_volume 466.89413
_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
Cs1 Cs 0.82228 0.82228 0.36175 1.00000
Cs2 Cs 0.17772 0.17772 0.63825 1.00000
Rb1 Rb 0.00000 0.00000 0.00000 1.00000
Ge1 Ge 0.61501 0.61501 0.80481 1.00000
Ge2 Ge 0.38499 0.38499 0.19519 1.00000
Br1 Br 0.50000 0.50000 0.00000 1.00000
Br2 Br 0.30130 0.30130 0.38670 1.00000
Br3 Br 0.69870 0.69870 0.61330 1.00000
Br4 Br 0.92769 0.41155 0.18747 1.00000
Br5 Br 0.41155 0.92769 0.18747 1.00000
Br6 Br 0.58845 0.07231 0.81253 1.00000
Br7 Br 0.07231 0.58845 0.81253 1.00000
Get direct link