Pu4GaSn
Alexandria ALEXAlex-ID: agm005770167 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_1206_spg12
Pu2Sn PuGa Pu
2023-07-28 11:06:43.971644
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005770167).
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 agm005770167
data_agm005770167
_cell_length_a 4.34630
_cell_length_b 6.52384
_cell_length_c 6.52383
_cell_angle_alpha 103.07906
_cell_angle_beta 70.54293
_cell_angle_gamma 70.54288
_cell_volume 152.16367
_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 0.73718 0.61603 0.90959 1.00000
Pu2 Pu 0.73718 0.90959 0.61603 1.00000
Pu3 Pu 0.26276 0.38397 0.09041 1.00000
Pu4 Pu 0.26276 0.09041 0.38397 1.00000
Ga1 Ga 0.99997 0.00000 0.00000 1.00000
Sn1 Sn 0.49997 0.50000 0.50000 1.00000
