Np(U3C4)2
Alexandria ALEXAlex-ID: agm072147707 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_172_spg166
UC2 UC Np2UC2
2024-10-05 13:51:20.407770
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072147707).
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 agm072147707
data_agm072147707
_cell_length_a 5.94932
_cell_length_b 6.15607
_cell_length_c 6.30093
_cell_angle_alpha 101.69058
_cell_angle_beta 99.52900
_cell_angle_gamma 100.49385
_cell_volume 217.23417
_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 0.00000 0.00000 0.00000 1.00000
U1 U 0.84721 0.71531 0.42796 1.00000
U2 U 0.76213 0.43384 0.89689 1.00000
U3 U 0.44135 0.85967 0.71375 1.00000
U4 U 0.15279 0.28469 0.57204 1.00000
U5 U 0.23787 0.56616 0.10311 1.00000
U6 U 0.55865 0.14033 0.28625 1.00000
C1 C 0.56025 0.48258 0.59574 1.00000
C2 C 0.43975 0.51742 0.40426 1.00000
C3 C 0.08679 0.65412 0.74934 1.00000
C4 C 0.62454 0.78590 0.08271 1.00000
C5 C 0.78635 0.07161 0.62662 1.00000
C6 C 0.91321 0.34588 0.25066 1.00000
C7 C 0.37546 0.21410 0.91729 1.00000
C8 C 0.21365 0.92839 0.37338 1.00000
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