Co8H
Alexandria ALEXAlex-ID: agm007333314 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB8_5_spg139
Co2H Co
2024-11-05 10:55:50.927009
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007333314).
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
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# CIF generated by HEAS from Alexandria entry agm007333314
data_agm007333314
_cell_length_a 4.35585
_cell_length_b 4.76747
_cell_length_c 5.03112
_cell_angle_alpha 105.36506
_cell_angle_beta 89.98883
_cell_angle_gamma 117.21125
_cell_volume 88.69813
_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 0.20343 0.74656 0.19184 1.00000
Co2 Co 0.20303 0.74569 0.68134 1.00000
Co3 Co 0.79697 0.25431 0.31866 1.00000
Co4 Co 0.79657 0.25344 0.80816 1.00000
Co5 Co 0.70810 0.74882 0.43765 1.00000
Co6 Co 0.29190 0.25118 0.56235 1.00000
Co7 Co 0.28949 0.25572 0.06467 1.00000
Co8 Co 0.71051 0.74428 0.93533 1.00000
H1 H 0.50000 0.00000 0.00000 1.00000
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