SiAg4
Alexandria ALEXAlex-ID: agm005407919 · Space group: I4/m (#87)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4_0_spg87
Ag Si
2023-03-17 21:18:30.794370
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005407919).
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 agm005407919
data_agm005407919
_cell_length_a 4.97453
_cell_length_b 4.97453
_cell_length_c 4.97453
_cell_angle_alpha 100.73550
_cell_angle_beta 100.73550
_cell_angle_gamma 128.86218
_cell_volume 86.46501
_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
Si1 Si 0.00000 0.00000 0.00000 1.00000
Ag1 Ag 0.80296 0.38605 0.18901 1.00000
Ag2 Ag 0.38605 0.19704 0.58309 1.00000
Ag3 Ag 0.19704 0.61395 0.81099 1.00000
Ag4 Ag 0.61395 0.80296 0.41691 1.00000
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