SbF3
Alexandria ALEXAlex-ID: agm075286529 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3_5610_spg8
SbF3
2025-01-14 14:15:58
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm075286529).
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 agm075286529
data_agm075286529
_cell_length_a 8.76241
_cell_length_b 8.76241
_cell_length_c 4.47825
_cell_angle_alpha 79.45359
_cell_angle_beta 100.54641
_cell_angle_gamma 57.61535
_cell_volume 268.60046
_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
Sb1 Sb 0.71688 0.76638 0.16309 1.00000
Sb2 Sb 0.23362 0.28312 0.16309 1.00000
Sb3 Sb 0.72253 0.27747 0.14589 1.00000
F1 F 0.75428 0.97456 0.13938 1.00000
F2 F 0.15735 0.34331 0.68911 1.00000
F3 F 0.43665 0.96001 0.05521 1.00000
F4 F 0.44773 0.37437 0.04154 1.00000
F5 F 0.68400 0.31600 0.67797 1.00000
F6 F 0.62563 0.55227 0.04154 1.00000
F7 F 0.65669 0.84265 0.68911 1.00000
F8 F 0.03999 0.56335 0.05521 1.00000
F9 F 0.02544 0.24572 0.13938 1.00000
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