Pu(AgO3)2
Alexandria ALEXAlex-ID: agm005653670 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_958_spg12
PuAgO4 AgO AgO5
2023-07-09 02:37:42.154637
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005653670).
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 agm005653670
data_agm005653670
_cell_length_a 3.92560
_cell_length_b 5.41928
_cell_length_c 7.86441
_cell_angle_alpha 102.54399
_cell_angle_beta 86.13972
_cell_angle_gamma 105.30962
_cell_volume 157.50872
_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 0.50000 1.00000
Ag1 Ag 0.81539 0.63475 0.88330 1.00000
Ag2 Ag 0.18461 0.36525 0.11670 1.00000
O1 O 0.30164 0.62067 0.94600 1.00000
O2 O 0.69836 0.37933 0.05400 1.00000
O3 O 0.07898 0.09629 0.28028 1.00000
O4 O 0.71852 0.23400 0.56870 1.00000
O5 O 0.92102 0.90372 0.71972 1.00000
O6 O 0.28148 0.76599 0.43130 1.00000
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