Ce2InF8
Alexandria ALEXAlex-ID: agm005930697 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_543_spg12
InF2 CeF3
2023-10-15 21:24:06.470279
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005930697).
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 agm005930697
data_agm005930697
_cell_length_a 4.49028
_cell_length_b 6.65507
_cell_length_c 6.65508
_cell_angle_alpha 114.21828
_cell_angle_beta 94.28380
_cell_angle_gamma 94.28381
_cell_volume 179.64742
_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
F1 F 0.42682 0.95377 0.66140 1.00000
F2 F 0.42682 0.66140 0.95377 1.00000
F3 F 0.75747 0.59797 0.59797 1.00000
F4 F 0.99540 0.26717 0.72326 1.00000
F5 F 0.99540 0.72326 0.26717 1.00000
F6 F 0.23921 0.40148 0.40148 1.00000
F7 F 0.54852 0.33479 0.03883 1.00000
F8 F 0.54852 0.03883 0.33479 1.00000
Ce1 Ce 0.49796 0.67359 0.32333 1.00000
Ce2 Ce 0.49796 0.32333 0.67359 1.00000
In1 In 0.06627 0.99047 0.99047 1.00000
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