Co8Rh6N
Alexandria ALEXAlex-ID: agm072145562 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_677_spg2
RhN2 Co Rh
2024-10-06 23:19:25.997297
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072145562).
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 agm072145562
data_agm072145562
_cell_length_a 4.60716
_cell_length_b 6.26850
_cell_length_c 6.80021
_cell_angle_alpha 93.48657
_cell_angle_beta 90.40316
_cell_angle_gamma 111.88926
_cell_volume 181.80045
_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
Co1 Co 0.17509 0.99196 0.75106 1.00000
Co2 Co 0.82491 0.00804 0.24894 1.00000
Co3 Co 0.41670 0.14232 0.10757 1.00000
Co4 Co 0.12168 0.57358 0.68572 1.00000
Co5 Co 0.96634 0.28963 0.96754 1.00000
Co6 Co 0.58330 0.85768 0.89243 1.00000
Co7 Co 0.87832 0.42642 0.31428 1.00000
Co8 Co 0.03366 0.71037 0.03246 1.00000
Rh1 Rh 0.55178 0.43094 0.82522 1.00000
Rh2 Rh 0.69661 0.71467 0.53654 1.00000
Rh3 Rh 0.25957 0.85161 0.39111 1.00000
Rh4 Rh 0.44822 0.56906 0.17478 1.00000
Rh5 Rh 0.30339 0.28533 0.46346 1.00000
Rh6 Rh 0.74043 0.14839 0.60889 1.00000
N1 N 0.00000 0.00000 0.00000 1.00000
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