AcDyHg4
Alexandria ALEXAlex-ID: agm005778422 · Space group: Pmmm (#47)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_1118_spg47
Dy3Hg5 AcHg2 AcHg3
2023-07-28 04:52:30.957610
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005778422).
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 agm005778422
data_agm005778422
_cell_length_a 3.62398
_cell_length_b 5.09026
_cell_length_c 8.75433
_cell_angle_alpha 90.00075
_cell_angle_beta 89.99920
_cell_angle_gamma 90.00222
_cell_volume 161.49095
_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 0.99860 0.99729 0.49814 1.00000
Dy1 Dy 0.99857 0.49729 0.99814 1.00000
Hg1 Hg 0.49858 0.99727 0.15846 1.00000
Hg2 Hg 0.49849 0.99730 0.83780 1.00000
Hg3 Hg 0.49867 0.49730 0.67538 1.00000
Hg4 Hg 0.49860 0.49728 0.32091 1.00000
