K14NaAg
Alexandria ALEXAlex-ID: agm005770057 · Space group: Amm2 (#38)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC14_31_spg38
KNa2 NaAg2 K
2023-07-19 00:14:22.543189
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005770057).
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 agm005770057
data_agm005770057
_cell_length_a 9.10739
_cell_length_b 9.10739
_cell_length_c 12.96839
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 104.65027
_cell_volume 1040.68401
_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 0.10367 0.89633 1.00000 1.00000
K2 K 0.57153 0.42847 1.00000 1.00000
K3 K 0.15769 0.40348 0.50000 1.00000
K4 K 0.04755 0.37393 1.00000 1.00000
K5 K 0.59652 0.84231 0.50000 1.00000
K6 K 0.62607 0.95245 1.00000 1.00000
K7 K 0.43922 0.17491 0.68982 1.00000
K8 K 0.43922 0.17491 0.31018 1.00000
K9 K 0.82509 0.56078 0.68982 1.00000
K10 K 0.82509 0.56078 0.31018 1.00000
K11 K 0.33235 0.66765 0.76883 1.00000
K12 K 0.33235 0.66765 0.23117 1.00000
K13 K 0.91197 0.08803 0.71418 1.00000
K14 K 0.91197 0.08803 0.28582 1.00000
Na1 Na 0.12936 0.87064 0.50000 1.00000
Ag1 Ag 0.75036 0.24964 0.50000 1.00000
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