ZnCoH4Os
Alexandria ALEXAlex-ID: agm007656270 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD4_512_spg11
ZnH8Os Zn11Co2 Os Co
2024-03-15 17:34:08.192993
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007656270).
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 agm007656270
data_agm007656270
_cell_length_a 4.62244
_cell_length_b 4.69618
_cell_length_c 5.31694
_cell_angle_alpha 97.57104
_cell_angle_beta 99.92748
_cell_angle_gamma 104.38241
_cell_volume 108.26875
_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
Zn1 Zn 0.25460 0.13403 0.40591 1.00000
Zn2 Zn 0.74540 0.86597 0.59409 1.00000
Co1 Co 0.21877 0.67769 0.66953 1.00000
Co2 Co 0.78123 0.32231 0.33047 1.00000
H1 H 0.95791 0.32095 0.63618 1.00000
H2 H 0.04209 0.67905 0.36382 1.00000
H3 H 0.93457 0.24715 0.05182 1.00000
H4 H 0.60873 0.92398 0.23470 1.00000
H5 H 0.52108 0.70167 0.92302 1.00000
H6 H 0.47892 0.29833 0.07698 1.00000
H7 H 0.39127 0.07602 0.76530 1.00000
H8 H 0.06543 0.75285 0.94818 1.00000
Os1 Os 0.69557 0.40090 0.83003 1.00000
Os2 Os 0.30443 0.59910 0.16997 1.00000
Get direct link