AlAg(WO4)2
Alexandria ALEXAlex-ID: agm005287611 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_328_spg12
AlAgO2 WO3
2023-05-05 08:19:27.090039
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005287611).
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 agm005287611
data_agm005287611
_cell_length_a 5.13818
_cell_length_b 5.71774
_cell_length_c 5.68342
_cell_angle_alpha 110.86770
_cell_angle_beta 91.75622
_cell_angle_gamma 110.53213
_cell_volume 143.78046
_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
Al1 Al 0.00000 0.00000 0.50000 1.00000
Ag1 Ag 0.50000 0.00000 0.00000 1.00000
W1 W 0.25340 0.50058 0.18688 1.00000
W2 W 0.74660 0.49942 0.81312 1.00000
O1 O 0.21667 0.79044 0.44163 1.00000
O2 O 0.22685 0.25345 0.33197 1.00000
O3 O 0.13230 0.68507 0.95642 1.00000
O4 O 0.32775 0.29520 0.81591 1.00000
O5 O 0.77315 0.74655 0.66803 1.00000
O6 O 0.78333 0.20956 0.55837 1.00000
O7 O 0.86770 0.31493 0.04358 1.00000
O8 O 0.67225 0.70480 0.18409 1.00000
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