K2Na5Ag4
Alexandria ALEXAlex-ID: agm003364705 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_97_spg12
KNa2 NaAg2 K
2022-02-09 12:08:49.422418
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003364705).
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 agm003364705
data_agm003364705
_cell_length_a 6.81670
_cell_length_b 8.14245
_cell_length_c 8.98402
_cell_angle_alpha 61.92669
_cell_angle_beta 67.70477
_cell_angle_gamma 65.25438
_cell_volume 389.09591
_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
K1 K 0.25459 0.86282 0.62801 1.00000
K2 K 0.74541 0.13718 0.37199 1.00000
Na1 Na 0.14709 0.30019 0.90768 1.00000
Na2 Na 0.85291 0.69981 0.09232 1.00000
Na3 Na 0.00000 0.50000 0.50000 1.00000
Na4 Na 0.64504 0.30019 0.90768 1.00000
Na5 Na 0.35496 0.69981 0.09232 1.00000
Ag1 Ag 0.41794 0.98506 0.17906 1.00000
Ag2 Ag 0.58206 0.01494 0.82094 1.00000
Ag3 Ag 0.77872 0.66526 0.77729 1.00000
Ag4 Ag 0.22128 0.33474 0.22271 1.00000
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