Np2Ni
Alexandria ALEXAlex-ID: agm010168268 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2_70_spg71
NpNi Np
2024-07-11 08:09:06.248301
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010168268).
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 agm010168268
data_agm010168268
_cell_length_a 4.33352
_cell_length_b 5.53986
_cell_length_c 4.79944
_cell_angle_alpha 91.56661
_cell_angle_beta 100.06447
_cell_angle_gamma 116.62918
_cell_volume 100.68035
_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 0.48679 0.87813 0.76883 1.00000
Np2 Np 0.51321 0.12187 0.23117 1.00000
Np3 Np 0.87775 0.58472 0.79335 1.00000
Np4 Np 0.12225 0.41528 0.20665 1.00000
Ni1 Ni 0.84387 0.80461 0.31003 1.00000
Ni2 Ni 0.15613 0.19539 0.68997 1.00000
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