NaIn2
Alexandria ALEXAlex-ID: agm078553031 · Space group: P2_1/m (#11)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2_7_spg36
NaIn2
2025-04-16 16:25:44
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm078553031).
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 agm078553031
data_agm078553031
_cell_length_a 3.47971
_cell_length_b 8.91999
_cell_length_c 5.39118
_cell_angle_alpha 90.00000
_cell_angle_beta 107.86093
_cell_angle_gamma 90.00000
_cell_volume 159.27190
_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 0.07544 0.25000 0.67090 1.00000
Na2 Na 0.92456 0.75000 0.32910 1.00000
In1 In 0.36435 0.42472 0.21959 1.00000
In2 In 0.63565 0.57528 0.78041 1.00000
In3 In 0.36435 0.07528 0.21959 1.00000
In4 In 0.63565 0.92472 0.78041 1.00000
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