CeGeF5
Alexandria ALEXAlex-ID: agm005735232 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC5_463_spg15
Ce3F10 GeF2 Ge
2023-07-14 06:23:13.187452
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005735232).
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 agm005735232
data_agm005735232
_cell_length_a 5.94390
_cell_length_b 6.17323
_cell_length_c 9.05977
_cell_angle_alpha 111.69766
_cell_angle_beta 99.03633
_cell_angle_gamma 103.85642
_cell_volume 288.55992
_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
Ce1 Ce 0.99908 0.00131 0.99942 1.00000
Ce2 Ce 0.99914 0.50141 0.49944 1.00000
Ge1 Ge 0.51703 0.27299 0.74807 1.00000
Ge2 Ge 0.48114 0.72955 0.25061 1.00000
F1 F 0.91691 0.16393 0.25114 1.00000
F2 F 0.08133 0.83883 0.74774 1.00000
F3 F 0.68082 0.58745 0.39033 1.00000
F4 F 0.23065 0.82328 0.10637 1.00000
F5 F 0.31205 0.38479 0.09927 1.00000
F6 F 0.25535 0.71558 0.38501 1.00000
F7 F 0.68629 0.61763 0.89945 1.00000
F8 F 0.74267 0.28680 0.61350 1.00000
F9 F 0.76736 0.17896 0.89225 1.00000
F10 F 0.31736 0.41507 0.60835 1.00000
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