Pu5(GePt)2
Alexandria ALEXAlex-ID: agm003312972 · Space group: Ima2 (#46)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_204_spg46
PuGePt Pu5Ge3 PuPt
2022-01-22 18:13:29.453749
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003312972).
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 agm003312972
data_agm003312972
_cell_length_a 9.09124
_cell_length_b 5.84448
_cell_length_c 9.56161
_cell_angle_alpha 107.79560
_cell_angle_beta 118.38564
_cell_angle_gamma 90.00000
_cell_volume 419.12305
_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 0.13756 0.66775 0.85549 1.00000
Pu2 Pu 0.86244 0.81226 0.14451 1.00000
Pu3 Pu 0.21793 0.16775 0.85549 1.00000
Pu4 Pu 0.78207 0.31226 0.14451 1.00000
Pu5 Pu 0.29587 0.09876 0.30184 1.00000
Pu6 Pu 0.70413 0.79692 0.69816 1.00000
Pu7 Pu 0.50597 0.59876 0.30184 1.00000
Pu8 Pu 0.49403 0.29692 0.69816 1.00000
Pu9 Pu 0.21323 0.70634 0.50000 1.00000
Pu10 Pu 0.78677 0.20634 0.50000 1.00000
Ge1 Ge 0.00000 0.09449 1.00000 1.00000
Ge2 Ge 0.50000 0.59449 1.00000 1.00000
Ge3 Ge 0.11167 0.21772 0.50000 1.00000
Ge4 Ge 0.88833 0.71772 0.50000 1.00000
Pt1 Pt 0.14896 0.55132 0.16089 1.00000
Pt2 Pt 0.85104 0.39043 0.83911 1.00000
Pt3 Pt 0.51193 0.05132 0.16088 1.00000
Pt4 Pt 0.48807 0.89043 0.83911 1.00000
Get direct link