Np4U2P3
Alexandria ALEXAlex-ID: agm005659031 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_273_spg12
U2P Np2P
2023-06-30 21:13:30.280222
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005659031).
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 agm005659031
data_agm005659031
_cell_length_a 4.49787
_cell_length_b 5.04438
_cell_length_c 7.95712
_cell_angle_alpha 83.80322
_cell_angle_beta 90.00034
_cell_angle_gamma 63.52195
_cell_volume 160.42157
_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 0.31741 0.36514 0.00480 1.00000
Np2 Np 0.99066 0.01864 0.34603 1.00000
Np3 Np 0.00934 0.98136 0.65397 1.00000
Np4 Np 0.68259 0.63486 0.99520 1.00000
U1 U 0.65311 0.69378 0.67314 1.00000
U2 U 0.34689 0.30622 0.32686 1.00000
P1 P 0.66707 0.66584 0.33161 1.00000
P2 P 0.00000 0.00000 0.00000 1.00000
P3 P 0.33293 0.33416 0.66839 1.00000
Get direct link