Pu(Ag3O4)2
Alexandria ALEXAlex-ID: agm006046986 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_150_spg71
PuAgO4 Ag2O AgO
2023-08-31 10:29:58.477405
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006046986).
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 agm006046986
data_agm006046986
_cell_length_a 7.24867
_cell_length_b 6.35169
_cell_length_c 7.24868
_cell_angle_alpha 64.01540
_cell_angle_beta 51.96902
_cell_angle_gamma 64.01556
_cell_volume 229.54023
_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 0.00000 0.00000 0.00000 1.00000
Ag1 Ag 0.00000 0.50000 0.50000 1.00000
Ag2 Ag 0.50000 0.00000 0.00000 1.00000
Ag3 Ag 0.50000 0.50000 0.00000 1.00000
Ag4 Ag 0.00000 0.00000 0.50000 1.00000
Ag5 Ag 0.00000 0.50000 0.00000 1.00000
Ag6 Ag 0.50000 0.00000 0.50000 1.00000
O1 O 0.75000 0.75000 0.75000 1.00000
O2 O 0.25000 0.25000 0.25000 1.00000
O3 O 0.77787 0.22213 0.22213 1.00000
O4 O 0.22213 0.77787 0.77787 1.00000
O5 O 0.22213 0.22213 0.77787 1.00000
O6 O 0.77787 0.77787 0.22213 1.00000
O7 O 0.80139 0.19861 0.80139 1.00000
O8 O 0.19861 0.80139 0.19861 1.00000
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