Np4Sb3N2
Alexandria ALEXAlex-ID: agm005644005 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_679_spg2
Np2Sb Np2SbN2 Np4Sb5
2023-06-27 19:32:12.056061
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005644005).
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 agm005644005
data_agm005644005
_cell_length_a 3.93695
_cell_length_b 6.92422
_cell_length_c 8.37802
_cell_angle_alpha 69.61921
_cell_angle_beta 76.41092
_cell_angle_gamma 73.48368
_cell_volume 202.89433
_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
Np1 Np 0.29939 0.28102 0.12020 1.00000
Np2 Np 0.70061 0.71898 0.87980 1.00000
Np3 Np 0.12225 0.16733 0.58818 1.00000
Np4 Np 0.87775 0.83267 0.41182 1.00000
Sb1 Sb 0.40382 0.49272 0.69964 1.00000
Sb2 Sb 0.00000 0.00000 0.00000 1.00000
Sb3 Sb 0.59618 0.50728 0.30036 1.00000
N1 N 0.30350 0.02964 0.36336 1.00000
N2 N 0.69650 0.97036 0.63664 1.00000
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