Na3(AgP)2
Alexandria ALEXAlex-ID: agm010124980 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_1677_spg166
Na2AgP Ag NaP
2024-03-17 15:35:21.364424
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010124980).
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 agm010124980
data_agm010124980
_cell_length_a 4.36792
_cell_length_b 4.36792
_cell_length_c 9.52520
_cell_angle_alpha 76.71149
_cell_angle_beta 76.71149
_cell_angle_gamma 60.00652
_cell_volume 151.74655
_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
Na2 Na 0.86898 0.86898 0.39241 1.00000
Na3 Na 0.13102 0.13102 0.60759 1.00000
Ag1 Ag 0.73907 0.73907 0.78253 1.00000
Ag2 Ag 0.26093 0.26093 0.21747 1.00000
P1 P 0.59066 0.59066 0.22802 1.00000
P2 P 0.40934 0.40934 0.77198 1.00000
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