Np4U3Pb4
Alexandria ALEXAlex-ID: agm009864751 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_28_spg1
Np U Pb
2024-03-31 17:53:01
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009864751).
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 agm009864751
data_agm009864751
_cell_length_a 3.83575
_cell_length_b 5.66268
_cell_length_c 13.06379
_cell_angle_alpha 76.26092
_cell_angle_beta 78.55849
_cell_angle_gamma 77.20836
_cell_volume 265.59175
_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 0.16551 0.79948 0.17047 1.00000
Np2 Np 0.12820 0.12414 0.55092 1.00000
Np3 Np 0.96253 0.87600 0.44908 1.00000
Np4 Np 0.92561 0.20038 0.82955 1.00000
U1 U 0.33812 0.03927 0.28105 1.00000
U2 U 0.75269 0.96078 0.71895 1.00000
U3 U 0.54557 0.99986 0.00002 1.00000
Pb1 Pb 0.82002 0.38001 0.10213 1.00000
Pb2 Pb 0.27108 0.61985 0.89782 1.00000
Pb3 Pb 0.44055 0.53781 0.63579 1.00000
Pb4 Pb 0.65026 0.46227 0.36422 1.00000
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