NaSrGa
Alexandria ALEXAlex-ID: agm003609934 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_56_spg63
Sr8Ga7 SrGa2 Na
2022-03-07 23:25:23.913126
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003609934).
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 agm003609934
data_agm003609934
_cell_length_a 4.41347
_cell_length_b 4.66088
_cell_length_c 10.24909
_cell_angle_alpha 102.76789
_cell_angle_beta 89.98432
_cell_angle_gamma 89.99846
_cell_volume 205.61736
_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
Na1 Na 0.63607 0.83102 0.50935 1.00000
Na2 Na 0.13587 0.23379 0.31563 1.00000
Sr1 Sr 0.63659 0.61678 0.08420 1.00000
Sr2 Sr 0.13699 0.44815 0.74071 1.00000
Ga1 Ga 0.13611 0.06694 0.98083 1.00000
Ga2 Ga 0.63615 0.99796 0.84391 1.00000
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