NpGa9Co2
Alexandria ALEXAlex-ID: agm005919331 · Space group: I4_1/amd (#141)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C9_2_spg141
NpGa5Co Ga3Co Ga
2023-07-24 07:04:32.990912
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005919331).
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 agm005919331
data_agm005919331
_cell_length_a 7.26073
_cell_length_b 8.15786
_cell_length_c 8.15777
_cell_angle_alpha 78.57830
_cell_angle_beta 63.57700
_cell_angle_gamma 63.57580
_cell_volume 387.51350
_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 0.50000 0.00000 0.00000 1.00000
Np2 Np 0.25000 0.50000 0.50000 1.00000
Ga1 Ga 0.75000 0.50000 0.50000 1.00000
Ga2 Ga 0.00000 0.00000 0.00000 1.00000
Ga3 Ga 0.00959 0.92229 0.67983 1.00000
Ga4 Ga 0.61171 0.07771 0.32017 1.00000
Ga5 Ga 0.68188 0.17983 0.57771 1.00000
Ga6 Ga 0.43942 0.82017 0.42229 1.00000
Ga7 Ga 0.74041 0.82017 0.57771 1.00000
Ga8 Ga 0.13829 0.17983 0.42229 1.00000
Ga9 Ga 0.06812 0.92229 0.32017 1.00000
Ga10 Ga 0.31058 0.07771 0.67983 1.00000
Ga11 Ga 0.74041 0.57771 0.82017 1.00000
Ga12 Ga 0.13829 0.42229 0.17983 1.00000
Ga13 Ga 0.06812 0.32017 0.92229 1.00000
Ga14 Ga 0.31058 0.67983 0.07771 1.00000
Ga15 Ga 0.00959 0.67983 0.92229 1.00000
Ga16 Ga 0.61171 0.32017 0.07771 1.00000
Ga17 Ga 0.68188 0.57771 0.17983 1.00000
Ga18 Ga 0.43942 0.42229 0.82017 1.00000
Co1 Co 0.87500 0.25000 0.75000 1.00000
Co2 Co 0.87500 0.75000 0.25000 1.00000
Co3 Co 0.87500 0.25000 0.25000 1.00000
Co4 Co 0.37500 0.75000 0.75000 1.00000
