Hg2AuF4
Alexandria ALEXAlex-ID: agm096207004 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_3764_spg10
HgF2 Au
2025-04-12 01:08:55
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm096207004).
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 agm096207004
data_agm096207004
_cell_length_a 3.51449
_cell_length_b 5.84759
_cell_length_c 8.06527
_cell_angle_alpha 98.62639
_cell_angle_beta 91.82587
_cell_angle_gamma 54.14267
_cell_volume 132.49390
_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
Hg1 Hg 0.94908 0.06672 0.91770 1.00000
Hg2 Hg 0.52787 0.95369 0.42689 1.00000
Au1 Au 0.06802 0.45937 0.08639 1.00000
F1 F 0.79123 0.72096 0.87458 1.00000
F2 F 0.11897 0.86239 0.22504 1.00000
F3 F 0.97476 0.01373 0.61186 1.00000
F4 F 0.07007 0.42313 0.35755 1.00000
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