HoH6Au
Alexandria ALEXAlex-ID: agm079840800 · Space group: R3 (#146)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC6_59_spg160
HoH11 HoAu4 HoH3
2025-06-26 20:09:25
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm079840800).
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 agm079840800
data_agm079840800
_cell_length_a 5.07683
_cell_length_b 4.61778
_cell_length_c 5.06316
_cell_angle_alpha 89.76184
_cell_angle_beta 126.05307
_cell_angle_gamma 117.16072
_cell_volume 79.40088
_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 0.99636 0.99773 0.00244 1.00000
H1 H 0.89541 0.48952 0.06383 1.00000
H2 H 0.34151 0.40475 0.51040 1.00000
H3 H 0.42821 0.93978 0.59430 1.00000
H4 H 0.75496 0.49439 0.10464 1.00000
H5 H 0.15456 0.25815 0.50490 1.00000
H6 H 0.39206 0.89803 0.74028 1.00000
Au1 Au 0.53695 0.76765 0.22921 1.00000
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