Ac2HoHg4
Alexandria ALEXAlex-ID: agm006019971 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_2792_spg12
Ac3Hg4 AcHg2 HoHg
2023-09-28 22:48:18
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006019971).
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 agm006019971
data_agm006019971
_cell_length_a 5.06307
_cell_length_b 5.06307
_cell_length_c 10.85488
_cell_angle_alpha 76.51350
_cell_angle_beta 76.51350
_cell_angle_gamma 60.00000
_cell_volume 232.07900
_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
Ac1 Ac 0.75344 0.75344 0.73968 1.00000
Ac2 Ac 0.24656 0.24656 0.26032 1.00000
Ho1 Ho 0.00000 0.00000 0.00000 1.00000
Hg1 Hg 0.86004 0.86004 0.41987 1.00000
Hg2 Hg 0.13996 0.13996 0.58013 1.00000
Hg3 Hg 0.63715 0.63715 0.08856 1.00000
Hg4 Hg 0.36285 0.36285 0.91144 1.00000
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