K2InRhF8
Alexandria ALEXAlex-ID: agm061668052 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_460_spg2
KIn2F7 K2Rh5F17 K5Rh3F14
2024-12-31 04:09:48
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm061668052).
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 agm061668052
data_agm061668052
_cell_length_a 5.33681
_cell_length_b 6.60073
_cell_length_c 6.80263
_cell_angle_alpha 76.25273
_cell_angle_beta 71.60261
_cell_angle_gamma 74.48318
_cell_volume 216.00133
_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 0.36233 0.31448 0.87806 1.00000
K2 K 0.63767 0.68552 0.12194 1.00000
In1 In 0.00000 0.00000 0.50000 1.00000
Rh1 Rh 0.00000 0.50000 0.50000 1.00000
F1 F 0.23200 0.66923 0.55292 1.00000
F2 F 0.22218 0.01935 0.19719 1.00000
F3 F 0.76823 0.79563 0.44983 1.00000
F4 F 0.76800 0.33077 0.44708 1.00000
F5 F 0.77782 0.98065 0.80281 1.00000
F6 F 0.23177 0.20437 0.55017 1.00000
F7 F 0.17853 0.53889 0.19047 1.00000
F8 F 0.82147 0.46111 0.80953 1.00000
Get direct link