Sr12Ag5N2
Alexandria ALEXAlex-ID: agm003370443 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C12_4_spg12
Sr3Ag2 Sr7Ag3 Sr2N
2022-02-07 07:33:49.266155
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003370443).
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 agm003370443
data_agm003370443
_cell_length_a 8.17140
_cell_length_b 9.69108
_cell_length_c 9.98997
_cell_angle_alpha 105.06137
_cell_angle_beta 90.00000
_cell_angle_gamma 114.93528
_cell_volume 687.27377
_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 0.99844 0.99688 0.17604 1.00000
Sr2 Sr 0.10050 0.69048 0.92065 1.00000
Sr3 Sr 0.58999 0.69048 0.92065 1.00000
Sr4 Sr 0.10041 0.70306 0.42790 1.00000
Sr5 Sr 0.60265 0.70306 0.42790 1.00000
Sr6 Sr 0.50040 0.00081 0.81624 1.00000
Sr7 Sr 0.49960 0.99919 0.18376 1.00000
Sr8 Sr 0.89959 0.29694 0.57210 1.00000
Sr9 Sr 0.39735 0.29694 0.57210 1.00000
Sr10 Sr 0.89950 0.30952 0.07935 1.00000
Sr11 Sr 0.41001 0.30952 0.07935 1.00000
Sr12 Sr 0.00156 0.00312 0.82396 1.00000
Ag1 Ag 0.30573 0.61147 0.64776 1.00000
Ag2 Ag 0.30803 0.61606 0.15940 1.00000
Ag3 Ag 0.00000 0.00000 0.50000 1.00000
Ag4 Ag 0.69197 0.38394 0.84060 1.00000
Ag5 Ag 0.69427 0.38853 0.35224 1.00000
N1 N 0.75576 0.00000 0.00000 1.00000
N2 N 0.24424 0.00000 0.00000 1.00000
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