Sr8Ga2N
Alexandria ALEXAlex-ID: agm003531019 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_277_spg12
Sr2N Sr6Ga5N Sr
2022-04-24 21:35:59.655659
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003531019).
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 agm003531019
data_agm003531019
_cell_length_a 6.19369
_cell_length_b 7.21279
_cell_length_c 9.88254
_cell_angle_alpha 105.94489
_cell_angle_beta 108.26216
_cell_angle_gamma 90.00000
_cell_volume 401.32814
_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 0.42087 0.64904 0.84175 1.00000
Sr2 Sr 0.63345 0.93862 0.26691 1.00000
Sr3 Sr 0.78391 0.69709 0.56781 1.00000
Sr4 Sr 0.96947 0.22182 0.93894 1.00000
Sr5 Sr 0.21609 0.30291 0.43219 1.00000
Sr6 Sr 0.36655 0.06138 0.73309 1.00000
Sr7 Sr 0.57913 0.35096 0.15825 1.00000
Sr8 Sr 0.03053 0.77818 0.06106 1.00000
Ga1 Ga 0.80480 0.25437 0.60960 1.00000
Ga2 Ga 0.19520 0.74563 0.39040 1.00000
N1 N 0.50000 0.00000 0.00000 1.00000
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