V2As2O9
Alexandria ALEXAlex-ID: agm007885482 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C9_9_spg12
VAs2O7 V4O9 VAsO4
2024-12-23 07:19:32
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007885482).
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 agm007885482
data_agm007885482
_cell_length_a 7.51672
_cell_length_b 7.51672
_cell_length_c 9.69794
_cell_angle_alpha 55.47127
_cell_angle_beta 124.52873
_cell_angle_gamma 128.96065
_cell_volume 331.53921
_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
V1 V 0.06050 0.93950 0.38691 1.00000
V2 V 0.93950 0.06050 0.61309 1.00000
V3 V 0.86276 0.13724 0.91681 1.00000
V4 V 0.13724 0.86276 0.08319 1.00000
As1 As 0.73805 0.26195 0.14646 1.00000
As2 As 0.63759 0.36241 0.47720 1.00000
As3 As 0.26195 0.73805 0.85354 1.00000
As4 As 0.36241 0.63759 0.52280 1.00000
O1 O 0.89077 0.10923 0.35502 1.00000
O2 O 0.75852 0.24148 0.46398 1.00000
O3 O 0.76391 0.23609 0.99757 1.00000
O4 O 0.24148 0.75852 0.53602 1.00000
O5 O 0.24474 0.33135 0.63586 1.00000
O6 O 0.14896 0.43912 0.89076 1.00000
O7 O 0.43912 0.14896 0.10924 1.00000
O8 O 0.97416 0.02584 0.84642 1.00000
O9 O 0.75526 0.66865 0.36414 1.00000
O10 O 0.68565 0.31435 0.68407 1.00000
O11 O 0.10923 0.89077 0.64498 1.00000
O12 O 0.23609 0.76391 0.00243 1.00000
O13 O 0.56088 0.85104 0.89076 1.00000
O14 O 0.31435 0.68565 0.31593 1.00000
O15 O 0.85104 0.56088 0.10924 1.00000
O16 O 0.33135 0.24474 0.36414 1.00000
O17 O 0.02584 0.97416 0.15358 1.00000
O18 O 0.66865 0.75526 0.63586 1.00000
