K2Te2W2O11
Alexandria ALEXAlex-ID: agm009059442 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C2D11_3_spg15
K2Te4O9 K2Te(WO4)3
2024-12-05 14:34:56
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009059442).
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 agm009059442
data_agm009059442
_cell_length_a 9.29006
_cell_length_b 9.29006
_cell_length_c 10.30583
_cell_angle_alpha 65.82184
_cell_angle_beta 114.17816
_cell_angle_gamma 135.86715
_cell_volume 555.57662
_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
K1 K 0.50000 0.00000 0.00000 1.00000
K2 K 0.00000 0.50000 0.50000 1.00000
K3 K 0.22447 0.22447 0.75000 1.00000
K4 K 0.77553 0.77553 0.25000 1.00000
Te1 Te 0.60561 0.91037 0.40562 1.00000
Te2 Te 0.91037 0.60561 0.09438 1.00000
Te3 Te 0.39439 0.08963 0.59438 1.00000
Te4 Te 0.08963 0.39439 0.90562 1.00000
W1 W 0.18188 0.39701 0.26052 1.00000
W2 W 0.39701 0.18188 0.23948 1.00000
W3 W 0.81812 0.60299 0.73948 1.00000
W4 W 0.60299 0.81812 0.76052 1.00000
O1 O 0.17055 0.29014 0.44802 1.00000
O2 O 0.29014 0.17055 0.05198 1.00000
O3 O 0.82945 0.70986 0.55198 1.00000
O4 O 0.70986 0.82945 0.94802 1.00000
O5 O 0.93634 0.17598 0.17639 1.00000
O6 O 0.17598 0.93634 0.32361 1.00000
O7 O 0.06366 0.82402 0.82361 1.00000
O8 O 0.82402 0.06366 0.67639 1.00000
O9 O 0.35816 0.35816 0.25000 1.00000
O10 O 0.64184 0.64184 0.75000 1.00000
O11 O 0.50999 0.04962 0.25895 1.00000
O12 O 0.04962 0.50999 0.24105 1.00000
O13 O 0.49001 0.95038 0.74105 1.00000
O14 O 0.95038 0.49001 0.75895 1.00000
O15 O 0.46327 0.70761 0.29258 1.00000
O16 O 0.70761 0.46327 0.20742 1.00000
O17 O 0.53673 0.29239 0.70742 1.00000
O18 O 0.29239 0.53673 0.79258 1.00000
O19 O 0.42472 0.75978 0.53703 1.00000
O20 O 0.75978 0.42472 0.96297 1.00000
O21 O 0.57528 0.24022 0.46297 1.00000
O22 O 0.24022 0.57528 0.03703 1.00000
