Rb2Sr(TeO3)2
Alexandria ALEXAlex-ID: agm004577005 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D6_422_spg12
SrTeO3 Rb2TeO3
2022-06-24 19:21:07.604436
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004577005).
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 agm004577005
data_agm004577005
_cell_length_a 6.53218
_cell_length_b 6.01328
_cell_length_c 7.83194
_cell_angle_alpha 108.91389
_cell_angle_beta 90.00000
_cell_angle_gamma 122.89811
_cell_volume 238.27908
_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 0.70115 0.40230 0.14658 1.00000
Rb2 Rb 0.29885 0.59770 0.85342 1.00000
Sr1 Sr 0.50000 0.00000 0.50000 1.00000
Te1 Te 0.91415 0.82831 0.75700 1.00000
Te2 Te 0.08585 0.17169 0.24300 1.00000
O1 O 0.76072 0.52145 0.52713 1.00000
O2 O 0.19745 0.93984 0.24711 1.00000
O3 O 0.25762 0.06016 0.75289 1.00000
O4 O 0.80255 0.06016 0.75289 1.00000
O5 O 0.74238 0.93984 0.24711 1.00000
O6 O 0.23928 0.47855 0.47287 1.00000
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