NaMg2(InAg)2
Alexandria ALEXAlex-ID: agm004550737 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_139_spg166
NaIn2 MgAg
2022-06-22 08:06:23.812543
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004550737).
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 agm004550737
data_agm004550737
_cell_length_a 4.84453
_cell_length_b 4.84453
_cell_length_c 8.31837
_cell_angle_alpha 73.07051
_cell_angle_beta 73.07051
_cell_angle_gamma 60.00000
_cell_volume 159.22817
_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 0.00000 0.00000 0.00000 1.00000
Mg1 Mg 0.13297 0.13297 0.60110 1.00000
Mg2 Mg 0.86703 0.86703 0.39890 1.00000
In1 In 0.59597 0.59597 0.21208 1.00000
In2 In 0.40403 0.40403 0.78792 1.00000
Ag1 Ag 0.74823 0.74823 0.75531 1.00000
Ag2 Ag 0.25177 0.25177 0.24469 1.00000
Get direct link