Ag4Sn8F
Alexandria ALEXAlex-ID: agm097489478 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_829_spg6
Ag3Sn SnF2 Sn
2025-06-15 10:58:48
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097489478).
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 agm097489478
data_agm097489478
_cell_length_a 4.81745
_cell_length_b 8.21580
_cell_length_c 9.57324
_cell_angle_alpha 62.33319
_cell_angle_beta 90.29971
_cell_angle_gamma 84.58855
_cell_volume 333.56667
_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 0.08982 0.94203 0.84746 1.00000
Ag2 Ag 0.15155 0.53998 0.00713 1.00000
Ag3 Ag 0.00422 0.32352 0.60890 1.00000
Ag4 Ag 0.70131 0.03268 0.38663 1.00000
Sn1 Sn 0.68377 0.31718 0.05385 1.00000
Sn2 Sn 0.76258 0.64901 0.34033 1.00000
Sn3 Sn 0.90598 0.70320 0.68220 1.00000
Sn4 Sn 0.55645 0.09419 0.65794 1.00000
Sn5 Sn 0.21812 0.88875 0.30488 1.00000
Sn6 Sn 0.16518 0.26641 0.33234 1.00000
Sn7 Sn 0.46111 0.45476 0.71606 1.00000
Sn8 Sn 0.61958 0.73616 0.00439 1.00000
F1 F 0.18034 0.05212 0.05788 1.00000
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