SrZnAg
Alexandria ALEXAlex-ID: agm003598541 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_33_spg12
SrZnAg
2022-03-10 07:30:06.307888
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003598541).
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 agm003598541
data_agm003598541
_cell_length_a 4.78474
_cell_length_b 6.07985
_cell_length_c 6.16846
_cell_angle_alpha 79.04410
_cell_angle_beta 67.17988
_cell_angle_gamma 66.82803
_cell_volume 151.90651
_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 0.54774 0.20445 0.70008 1.00000
Sr2 Sr 0.45226 0.79555 0.29992 1.00000
Zn1 Zn 0.83756 0.22130 0.10358 1.00000
Zn2 Zn 0.16244 0.77870 0.89642 1.00000
Ag1 Ag 0.17158 0.39091 0.26593 1.00000
Ag2 Ag 0.82842 0.60909 0.73407 1.00000
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