CsHf2UO8
Alexandria ALEXAlex-ID: agm004906239 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_449_spg2
Cs2U2O7 Cs2HfU3O12 CsO12 HfO2
2023-01-06 07:37:28.840538
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004906239).
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 agm004906239
data_agm004906239
_cell_length_a 5.66934
_cell_length_b 5.66932
_cell_length_c 8.10961
_cell_angle_alpha 73.69111
_cell_angle_beta 73.68919
_cell_angle_gamma 70.05309
_cell_volume 230.15784
_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
Cs1 Cs 0.00000 0.00000 0.50000 1.00000
Hf1 Hf 0.44705 0.44706 0.73509 1.00000
Hf2 Hf 0.55295 0.55294 0.26491 1.00000
U1 U 0.00000 0.00000 0.00000 1.00000
O1 O 0.23161 0.75898 0.18517 1.00000
O2 O 0.77014 0.77015 0.09414 1.00000
O3 O 0.75898 0.23163 0.18517 1.00000
O4 O 0.76839 0.24102 0.81483 1.00000
O5 O 0.22986 0.22985 0.90586 1.00000
O6 O 0.24102 0.76837 0.81483 1.00000
O7 O 0.62198 0.62195 0.48009 1.00000
O8 O 0.37802 0.37805 0.51991 1.00000
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