Na8ZnP4
Alexandria ALEXAlex-ID: agm097895065 · Space group: Pm (#6)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1593_spg1
Na5P4 Na3P Na4ZnP2
2025-06-16 23:25:09
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097895065).
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 agm097895065
data_agm097895065
_cell_length_a 3.95375
_cell_length_b 10.24474
_cell_length_c 8.83140
_cell_angle_alpha 122.29835
_cell_angle_beta 90.01122
_cell_angle_gamma 89.95868
_cell_volume 302.37006
_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 0.76906 0.87042 0.28569 1.00000
Na2 Na 0.76970 0.33493 0.18821 1.00000
Na3 Na 0.76989 0.39737 0.64464 1.00000
Na4 Na 0.76906 0.73497 0.61394 1.00000
Na5 Na 0.26896 0.13906 0.28626 1.00000
Na6 Na 0.26948 0.62289 0.28758 1.00000
Na7 Na 0.26960 0.68647 0.90233 1.00000
Na8 Na 0.27049 0.28465 0.84363 1.00000
Zn1 Zn 0.26807 0.98680 0.86072 1.00000
P1 P 0.76836 0.97863 0.00720 1.00000
P2 P 0.76964 0.52883 0.01852 1.00000
P3 P 0.26956 0.47205 0.48226 1.00000
P4 P 0.26812 0.96293 0.57903 1.00000
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