CeHoF7
Alexandria ALEXAlex-ID: agm024137180 · Space group: P2_1 (#4)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC7_8_spg4
Ce3HoF15 HoF3
2024-12-10 19:43:49
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024137180).
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 agm024137180
data_agm024137180
_cell_length_a 6.21827
_cell_length_b 5.99919
_cell_length_c 8.48415
_cell_angle_alpha 90.00000
_cell_angle_beta 101.82131
_cell_angle_gamma 90.00000
_cell_volume 309.78550
_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 0.66003 0.29723 0.19331 1.00000
Ce2 Ce 0.33997 0.79723 0.80669 1.00000
Ho1 Ho 0.81258 0.29192 0.72853 1.00000
Ho2 Ho 0.18742 0.79192 0.27147 1.00000
F1 F 0.46378 0.11031 0.98461 1.00000
F2 F 0.53622 0.61031 0.01539 1.00000
F3 F 0.91126 0.56343 0.26382 1.00000
F4 F 0.08874 0.06343 0.73618 1.00000
F5 F 0.92791 0.04266 0.25448 1.00000
F6 F 0.07209 0.54266 0.74552 1.00000
F7 F 0.46028 0.02203 0.28612 1.00000
F8 F 0.53972 0.52203 0.71388 1.00000
F9 F 0.75469 0.30225 0.46855 1.00000
F10 F 0.24531 0.80225 0.53145 1.00000
F11 F 0.85478 0.30266 0.98940 1.00000
F12 F 0.14522 0.80266 0.01060 1.00000
F13 F 0.38701 0.49113 0.27146 1.00000
F14 F 0.61299 0.99113 0.72854 1.00000
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