CsNb(TeO4)2
Alexandria ALEXAlex-ID: agm004874580 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_330_spg12
CsNbTeO6 TeO2
2023-01-04 19:39:33.409639
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004874580).
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 agm004874580
data_agm004874580
_cell_length_a 5.80660
_cell_length_b 5.86046
_cell_length_c 9.37538
_cell_angle_alpha 70.15018
_cell_angle_beta 71.96047
_cell_angle_gamma 60.30352
_cell_volume 256.73399
_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 0.50000 0.50000 0.50000 1.00000
Nb1 Nb 0.00000 0.00000 0.00000 1.00000
Te1 Te 0.30055 0.22429 0.17460 1.00000
Te2 Te 0.69945 0.77571 0.82540 1.00000
O1 O 0.81328 0.74880 0.62463 1.00000
O2 O 0.81848 0.39303 0.97000 1.00000
O3 O 0.18672 0.25120 0.37537 1.00000
O4 O 0.18152 0.60697 0.03000 1.00000
O5 O 0.68132 0.97530 0.16498 1.00000
O6 O 0.31868 0.02470 0.83502 1.00000
O7 O 0.17839 0.97530 0.16498 1.00000
O8 O 0.82161 0.02470 0.83502 1.00000
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