KReF8
Alexandria ALEXAlex-ID: agm024282627 · Space group: P2_1/m (#11)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC8_382_spg85
KReF8
2025-03-22 07:32:27
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024282627).
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 agm024282627
data_agm024282627
_cell_length_a 5.17552
_cell_length_b 7.18818
_cell_length_c 7.81899
_cell_angle_alpha 89.73022
_cell_angle_beta 90.08606
_cell_angle_gamma 90.13569
_cell_volume 290.88181
_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
K1 K 0.48470 0.74798 0.74984 1.00000
K2 K 0.51530 0.25202 0.25016 1.00000
Re1 Re 0.11085 0.75024 0.24984 1.00000
Re2 Re 0.88915 0.24976 0.75016 1.00000
F1 F 0.07853 0.01655 0.75138 1.00000
F2 F 0.06394 0.48978 0.74979 1.00000
F3 F 0.10405 0.25432 0.55352 1.00000
F4 F 0.10283 0.25308 0.94782 1.00000
F5 F 0.31044 0.91084 0.39883 1.00000
F6 F 0.31376 0.91084 0.10249 1.00000
F7 F 0.32231 0.59644 0.39820 1.00000
F8 F 0.32093 0.59638 0.10182 1.00000
F9 F 0.68624 0.08916 0.89751 1.00000
F10 F 0.67769 0.40356 0.60180 1.00000
F11 F 0.67907 0.40362 0.89818 1.00000
F12 F 0.68956 0.08916 0.60117 1.00000
F13 F 0.89595 0.74568 0.44648 1.00000
F14 F 0.92147 0.98345 0.24862 1.00000
F15 F 0.93606 0.51022 0.25021 1.00000
F16 F 0.89717 0.74692 0.05218 1.00000
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