Sr3Ag8Hg3
Alexandria ALEXAlex-ID: agm005687319 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B3C8_0_spg71
SrAg5 SrHg2 Ag
2023-06-29 11:22:50.289825
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005687319).
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 agm005687319
data_agm005687319
_cell_length_a 4.80035
_cell_length_b 8.97697
_cell_length_c 9.01577
_cell_angle_alpha 68.55500
_cell_angle_beta 74.56057
_cell_angle_gamma 74.49217
_cell_volume 342.24824
_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
Sr1 Sr 0.30990 0.69238 0.68782 1.00000
Sr2 Sr 0.69010 0.30762 0.31218 1.00000
Sr3 Sr 0.00000 0.00000 0.00000 1.00000
Ag1 Ag 0.12190 0.15254 0.60367 1.00000
Ag2 Ag 0.87810 0.84746 0.39633 1.00000
Ag3 Ag 0.87605 0.40094 0.84697 1.00000
Ag4 Ag 0.12395 0.59906 0.15303 1.00000
Ag5 Ag 0.49837 0.71703 0.28622 1.00000
Ag6 Ag 0.50163 0.28297 0.71378 1.00000
Ag7 Ag 0.31884 0.02881 0.33351 1.00000
Ag8 Ag 0.68116 0.97119 0.66649 1.00000
Hg1 Hg 0.00000 0.50000 0.50000 1.00000
Hg2 Hg 0.67282 0.69563 0.95873 1.00000
Hg3 Hg 0.32718 0.30437 0.04127 1.00000
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