Ag7(SBr)2
Alexandria ALEXAlex-ID: agm005569718 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C7_1022_spg8
Ag2S Ag AgBr
2023-06-05 03:14:50.814018
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005569718).
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 agm005569718
data_agm005569718
_cell_length_a 4.73953
_cell_length_b 8.11729
_cell_length_c 8.11729
_cell_angle_alpha 112.28035
_cell_angle_beta 98.26255
_cell_angle_gamma 98.26254
_cell_volume 279.19626
_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
Ag1 Ag 0.72990 0.20498 0.48766 1.00000
Ag2 Ag 0.72990 0.48766 0.20498 1.00000
Ag3 Ag 0.20232 0.39613 0.39613 1.00000
Ag4 Ag 0.15685 0.93287 0.93287 1.00000
Ag5 Ag 0.82714 0.59662 0.59662 1.00000
Ag6 Ag 0.33711 0.79366 0.53177 1.00000
Ag7 Ag 0.33711 0.53177 0.79366 1.00000
S1 S 0.48586 0.20451 0.20451 1.00000
S2 S 0.61430 0.82480 0.82480 1.00000
Br1 Br 0.03975 0.79036 0.23665 1.00000
Br2 Br 0.03975 0.23665 0.79036 1.00000
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