CsUVO6
Alexandria ALEXAlex-ID: agm005221000 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD6_51_spg14
CsUVO6
2022-12-13 08:45:27.474411
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005221000).
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 agm005221000
data_agm005221000
_cell_length_a 8.49764
_cell_length_b 7.63693
_cell_length_c 10.63807
_cell_angle_alpha 74.86282
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 666.41435
_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 0.26570 0.53204 0.13499 1.00000
Cs2 Cs 0.76570 0.46796 0.36501 1.00000
Cs3 Cs 0.73430 0.46796 0.86501 1.00000
Cs4 Cs 0.23430 0.53204 0.63499 1.00000
U1 U 0.48035 0.98940 0.32044 1.00000
U2 U 0.98035 0.01060 0.17956 1.00000
U3 U 0.51965 0.01060 0.67956 1.00000
U4 U 0.01965 0.98940 0.82044 1.00000
V1 V 0.14696 0.10218 0.44317 1.00000
V2 V 0.64696 0.89782 0.05683 1.00000
V3 V 0.85304 0.89782 0.55683 1.00000
V4 V 0.35304 0.10218 0.94317 1.00000
O1 O 0.43818 0.74523 0.37528 1.00000
O2 O 0.93818 0.25477 0.12472 1.00000
O3 O 0.56182 0.25477 0.62472 1.00000
O4 O 0.06182 0.74523 0.87528 1.00000
O5 O 0.02305 0.76703 0.23524 1.00000
O6 O 0.52305 0.23297 0.26476 1.00000
O7 O 0.97695 0.23297 0.76476 1.00000
O8 O 0.47695 0.76703 0.73524 1.00000
O9 O 0.34508 0.03316 0.50486 1.00000
O10 O 0.84508 0.96684 0.99514 1.00000
O11 O 0.65492 0.96684 0.49514 1.00000
O12 O 0.15492 0.03316 0.00486 1.00000
O13 O 0.13077 0.32164 0.42853 1.00000
O14 O 0.63077 0.67836 0.07147 1.00000
O15 O 0.86923 0.67836 0.57147 1.00000
O16 O 0.36923 0.32164 0.92853 1.00000
O17 O 0.44091 0.97057 0.10705 1.00000
O18 O 0.94091 0.02943 0.39295 1.00000
O19 O 0.55909 0.02943 0.89295 1.00000
O20 O 0.05909 0.97057 0.60705 1.00000
O21 O 0.21032 0.07187 0.28367 1.00000
O22 O 0.71032 0.92813 0.21633 1.00000
O23 O 0.78968 0.92813 0.71633 1.00000
O24 O 0.28968 0.07187 0.78367 1.00000
