Ag2S4F
Alexandria ALEXAlex-ID: agm096568973 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_4305_spg12
AgS2 SF4 Ag2S
2025-04-12 01:59:34
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm096568973).
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
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# CIF generated by HEAS from Alexandria entry agm096568973
data_agm096568973
_cell_length_a 3.90943
_cell_length_b 7.06566
_cell_length_c 7.24787
_cell_angle_alpha 54.05621
_cell_angle_beta 105.50319
_cell_angle_gamma 89.86122
_cell_volume 152.89609
_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 0.13257 0.91537 0.91077 1.00000
Ag2 Ag 0.92894 0.54305 0.49961 1.00000
S1 S 0.34906 0.44484 0.33757 1.00000
S2 S 0.51519 0.88573 0.67429 1.00000
S3 S 0.32895 0.18779 0.29613 1.00000
S4 S 0.53131 0.58292 0.70655 1.00000
F1 F 0.71399 0.94030 0.07508 1.00000
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