NpUF7
Alexandria ALEXAlex-ID: agm024110131 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC7_7_spg14
NpU3F15 NpF3
2024-12-10 07:56:19.071028
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024110131).
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 agm024110131
data_agm024110131
_cell_length_a 6.16204
_cell_length_b 9.63365
_cell_length_c 11.93044
_cell_angle_alpha 107.69326
_cell_angle_beta 90.00669
_cell_angle_gamma 89.98315
_cell_volume 674.72470
_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 0.74563 0.91824 0.73336 1.00000
Np2 Np 0.24587 0.58194 0.76680 1.00000
Np3 Np 0.25437 0.08176 0.26664 1.00000
Np4 Np 0.75413 0.41806 0.23320 1.00000
U1 U 0.74337 0.27007 0.54526 1.00000
U2 U 0.24297 0.22991 0.95481 1.00000
U3 U 0.25663 0.72993 0.45474 1.00000
U4 U 0.75703 0.77009 0.04519 1.00000
F1 F 0.48065 0.36472 0.07968 1.00000
F2 F 0.98207 0.13583 0.42072 1.00000
F3 F 0.51935 0.63528 0.92032 1.00000
F4 F 0.01793 0.86417 0.57928 1.00000
F5 F 0.45140 0.16047 0.44826 1.00000
F6 F 0.94972 0.33845 0.05123 1.00000
F7 F 0.54860 0.83953 0.55174 1.00000
F8 F 0.05028 0.66155 0.94877 1.00000
F9 F 0.75951 0.61635 0.14808 1.00000
F10 F 0.25862 0.88329 0.35156 1.00000
F11 F 0.24049 0.38365 0.85192 1.00000
F12 F 0.74138 0.11671 0.64844 1.00000
F13 F 0.75750 0.92169 0.93893 1.00000
F14 F 0.25778 0.57861 0.56125 1.00000
F15 F 0.24250 0.07831 0.06107 1.00000
F16 F 0.74222 0.42139 0.43875 1.00000
F17 F 0.99078 0.60389 0.34452 1.00000
F18 F 0.49067 0.89563 0.15540 1.00000
F19 F 0.00922 0.39611 0.65548 1.00000
F20 F 0.50933 0.10437 0.84460 1.00000
F21 F 0.02931 0.07663 0.82432 1.00000
F22 F 0.52868 0.42279 0.67555 1.00000
F23 F 0.97069 0.92337 0.17568 1.00000
F24 F 0.47132 0.57721 0.32445 1.00000
F25 F 0.44810 0.77912 0.75446 1.00000
F26 F 0.94815 0.72109 0.74587 1.00000
F27 F 0.55190 0.22088 0.24554 1.00000
F28 F 0.05185 0.27891 0.25413 1.00000
