RbAg(IO3)4
Alexandria ALEXAlex-ID: agm018353092 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4D12_50_spg2
AgIO3 AgI3O8 Rb2I4O11 RbO12
2024-12-22 17:40:56
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm018353092).
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 agm018353092
data_agm018353092
_cell_length_a 7.74261
_cell_length_b 8.03320
_cell_length_c 10.95659
_cell_angle_alpha 103.48363
_cell_angle_beta 106.20101
_cell_angle_gamma 85.48058
_cell_volume 636.30843
_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
Rb1 Rb 0.93661 0.81634 0.12831 1.00000
Rb2 Rb 0.06339 0.18366 0.87169 1.00000
Ag1 Ag 0.42855 0.95899 0.21216 1.00000
Ag2 Ag 0.57145 0.04101 0.78784 1.00000
I1 I 0.72279 0.71364 0.40789 1.00000
I2 I 0.27721 0.28636 0.59211 1.00000
I3 I 0.33421 0.67083 0.90190 1.00000
I4 I 0.66579 0.32917 0.09810 1.00000
I5 I 0.75802 0.20963 0.46879 1.00000
I6 I 0.24198 0.79037 0.53121 1.00000
I7 I 0.23623 0.34775 0.25153 1.00000
I8 I 0.76377 0.65225 0.74847 1.00000
O1 O 0.64619 0.80074 0.25178 1.00000
O2 O 0.35381 0.19926 0.74822 1.00000
O3 O 0.66890 0.48633 0.33157 1.00000
O4 O 0.33110 0.51367 0.66843 1.00000
O5 O 0.95259 0.70024 0.39055 1.00000
O6 O 0.04741 0.29976 0.60945 1.00000
O7 O 0.28863 0.85914 0.83303 1.00000
O8 O 0.71137 0.14086 0.16697 1.00000
O9 O 0.57838 0.65563 0.94105 1.00000
O10 O 0.42162 0.34437 0.05895 1.00000
O11 O 0.29747 0.76456 0.06956 1.00000
O12 O 0.70253 0.23544 0.93044 1.00000
O13 O 0.50911 0.15461 0.37306 1.00000
O14 O 0.49089 0.84539 0.62694 1.00000
O15 O 0.80354 0.01590 0.53239 1.00000
O16 O 0.19646 0.98410 0.46761 1.00000
O17 O 0.67637 0.34606 0.59964 1.00000
O18 O 0.32363 0.65394 0.40036 1.00000
O19 O 0.21079 0.11271 0.15805 1.00000
O20 O 0.78921 0.88729 0.84195 1.00000
O21 O 0.12899 0.32848 0.37771 1.00000
O22 O 0.87101 0.67152 0.62229 1.00000
O23 O 0.04206 0.41458 0.13622 1.00000
O24 O 0.95794 0.58542 0.86378 1.00000
