Ho4HC2
Alexandria ALEXAlex-ID: agm006564566 · Space group: Fd-3m (#227)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_50_spg141
Ho6H2C3 Ho2C
2024-03-01 03:14:03.645945
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006564566).
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 agm006564566
data_agm006564566
_cell_length_a 7.20343
_cell_length_b 7.20343
_cell_length_c 7.20343
_cell_angle_alpha 60.00000
_cell_angle_beta 60.00000
_cell_angle_gamma 60.00000
_cell_volume 264.30388
_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
Ho1 Ho 0.35267 0.88244 0.88244 1.00000
Ho2 Ho 0.89733 0.36756 0.36756 1.00000
Ho3 Ho 0.88244 0.35267 0.88244 1.00000
Ho4 Ho 0.88244 0.88244 0.35267 1.00000
Ho5 Ho 0.88244 0.88244 0.88244 1.00000
Ho6 Ho 0.36756 0.89733 0.36756 1.00000
Ho7 Ho 0.36756 0.36756 0.89733 1.00000
Ho8 Ho 0.36756 0.36756 0.36756 1.00000
H1 H 0.50000 0.50000 0.50000 1.00000
H2 H 0.75000 0.75000 0.75000 1.00000
C1 C 0.62500 0.12500 0.12500 1.00000
C2 C 0.12500 0.62500 0.12500 1.00000
C3 C 0.12500 0.12500 0.62500 1.00000
C4 C 0.12500 0.12500 0.12500 1.00000
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