HoCdH4
Alexandria ALEXAlex-ID: agm007364580 · Space group: P2_1/m (#11)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_206_spg11
CdH4 HoH3 Cd
2024-07-02 08:55:34.172054
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007364580).
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 agm007364580
data_agm007364580
_cell_length_a 3.60547
_cell_length_b 5.83368
_cell_length_c 6.10694
_cell_angle_alpha 89.99676
_cell_angle_beta 104.77489
_cell_angle_gamma 89.99991
_cell_volume 124.20137
_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 0.65394 0.29147 0.32661 1.00000
Ho2 Ho 0.34609 0.79147 0.67339 1.00000
Cd1 Cd 0.15875 0.29140 0.81583 1.00000
Cd2 Cd 0.84116 0.79142 0.18417 1.00000
H1 H 0.81376 0.03585 0.61829 1.00000
H2 H 0.18628 0.53588 0.38169 1.00000
H3 H 0.81388 0.54712 0.61838 1.00000
H4 H 0.18618 0.04711 0.38160 1.00000
H5 H 0.94733 0.79158 0.88495 1.00000
H6 H 0.05270 0.29156 0.11507 1.00000
H7 H 0.50009 0.04158 0.00008 1.00000
H8 H 0.49988 0.54158 0.99994 1.00000
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