U(CoH2)4
Alexandria ALEXAlex-ID: agm007343136 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_161_spg1
CoH U(CoH3)2
2024-03-16 02:30:31.410525
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007343136).
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 agm007343136
data_agm007343136
_cell_length_a 5.09360
_cell_length_b 4.86097
_cell_length_c 5.11440
_cell_angle_alpha 114.34107
_cell_angle_beta 105.17258
_cell_angle_gamma 104.13186
_cell_volume 102.04103
_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
U1 U 0.57138 0.00354 0.32756 1.00000
Co1 Co 0.98477 0.00831 0.99133 1.00000
Co2 Co 0.48628 0.46480 0.05029 1.00000
Co3 Co 0.49092 0.45415 0.54215 1.00000
Co4 Co 0.03375 0.97859 0.50493 1.00000
H1 H 0.24778 0.38310 0.69793 1.00000
H2 H 0.75184 0.60970 0.42075 1.00000
H3 H 0.95733 0.19398 0.80685 1.00000
H4 H 0.72343 0.62514 0.90009 1.00000
H5 H 0.07759 0.81047 0.18176 1.00000
H6 H 0.19712 0.89724 0.82291 1.00000
H7 H 0.74405 0.16322 0.02892 1.00000
H8 H 0.23376 0.40775 0.22451 1.00000
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