Pu3NiGe2
Alexandria ALEXAlex-ID: agm005672486 · Space group: Pnma (#62)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_2056_spg62
Pu2Ni3Ge PuNiGe Pu5Ge3
2023-08-23 23:00:24.103736
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005672486).
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 agm005672486
data_agm005672486
_cell_length_a 4.21512
_cell_length_b 10.20850
_cell_length_c 11.83461
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 509.24355
_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 0.25000 0.40719 0.04819 1.00000
Pu2 Pu 0.75000 0.59281 0.95181 1.00000
Pu3 Pu 0.75000 0.90719 0.45181 1.00000
Pu4 Pu 0.25000 0.09281 0.54819 1.00000
Pu5 Pu 0.25000 0.73639 0.23474 1.00000
Pu6 Pu 0.75000 0.26361 0.76526 1.00000
Pu7 Pu 0.75000 0.23639 0.26526 1.00000
Pu8 Pu 0.25000 0.76361 0.73474 1.00000
Pu9 Pu 0.25000 0.44031 0.37382 1.00000
Pu10 Pu 0.75000 0.55969 0.62618 1.00000
Pu11 Pu 0.75000 0.94031 0.12618 1.00000
Pu12 Pu 0.25000 0.05969 0.87382 1.00000
Ni1 Ni 0.25000 0.14678 0.11572 1.00000
Ni2 Ni 0.75000 0.85322 0.88428 1.00000
Ni3 Ni 0.75000 0.64678 0.38428 1.00000
Ni4 Ni 0.25000 0.35322 0.61572 1.00000
Ge1 Ge 0.25000 0.70614 0.48844 1.00000
Ge2 Ge 0.75000 0.29386 0.51156 1.00000
Ge3 Ge 0.75000 0.20614 0.01156 1.00000
Ge4 Ge 0.25000 0.79386 0.98844 1.00000
Ge5 Ge 0.25000 0.02621 0.29650 1.00000
Ge6 Ge 0.75000 0.97379 0.70350 1.00000
Ge7 Ge 0.75000 0.52621 0.20350 1.00000
Ge8 Ge 0.25000 0.47379 0.79650 1.00000
