Na2W2O5
Alexandria ALEXAlex-ID: agm005285225 · Space group: Ima2 (#46)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_319_spg46
NaWO3 Na2WO4 W
2023-05-07 18:37:38.614213
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005285225).
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 agm005285225
data_agm005285225
_cell_length_a 8.84348
_cell_length_b 8.84348
_cell_length_c 8.84348
_cell_angle_alpha 142.45308
_cell_angle_beta 142.34596
_cell_angle_gamma 54.22750
_cell_volume 255.74586
_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
Na1 Na 0.62612 0.60848 0.02153 1.00000
Na2 Na 0.37388 0.39541 0.98236 1.00000
Na3 Na 0.08695 0.10848 0.98236 1.00000
Na4 Na 0.91305 0.89541 0.02153 1.00000
W1 W 0.50000 0.99872 0.49872 1.00000
W2 W 0.00000 0.49872 0.49872 1.00000
W3 W 0.60005 0.21938 0.31943 1.00000
W4 W 0.39995 0.71938 0.61934 1.00000
O1 O 0.77326 0.27373 0.99878 1.00000
O2 O 0.22674 0.22551 0.50047 1.00000
O3 O 0.77495 0.77373 0.50047 1.00000
O4 O 0.22505 0.72551 0.99878 1.00000
O5 O 0.53756 0.12524 0.39855 1.00000
O6 O 0.46244 0.86099 0.58768 1.00000
O7 O 0.22669 0.62524 0.58768 1.00000
O8 O 0.77331 0.36099 0.39855 1.00000
O9 O 0.70859 0.88639 0.09498 1.00000
O10 O 0.29141 0.38639 0.17780 1.00000
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