Pu3Ni3Ge8
Alexandria ALEXAlex-ID: agm005685138 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B3C8_28_spg71
Pu2Ni3Ge5 PuGe3
2023-06-29 15:11:45.857822
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005685138).
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 agm005685138
data_agm005685138
_cell_length_a 4.17529
_cell_length_b 8.34045
_cell_length_c 9.13537
_cell_angle_alpha 56.87666
_cell_angle_beta 76.78988
_cell_angle_gamma 75.50442
_cell_volume 256.29328
_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
Pu1 Pu 0.27844 0.75446 0.68867 1.00000
Pu2 Pu 0.72156 0.24554 0.31133 1.00000
Pu3 Pu 0.00000 0.00000 0.00000 1.00000
Ni1 Ni 0.99999 0.50000 0.50000 1.00000
Ni2 Ni 0.64849 0.69408 0.00895 1.00000
Ni3 Ni 0.35151 0.30592 0.99105 1.00000
Ge1 Ge 0.12429 0.17825 0.57317 1.00000
Ge2 Ge 0.87571 0.82175 0.42683 1.00000
Ge3 Ge 0.81902 0.46221 0.89976 1.00000
Ge4 Ge 0.18098 0.53779 0.10024 1.00000
Ge5 Ge 0.52719 0.64612 0.29951 1.00000
Ge6 Ge 0.47282 0.35388 0.70049 1.00000
Ge7 Ge 0.36856 0.01075 0.25214 1.00000
Ge8 Ge 0.63144 0.98925 0.74786 1.00000
Get direct link