HoV2ZnO6
Alexandria ALEXAlex-ID: agm005260192 · Space group: Pc (#7)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_59_spg31
HoVO3 V2ZnO4 HoVO4 ZnO
2023-05-08 14:02:39.469478
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005260192).
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 agm005260192
data_agm005260192
_cell_length_a 5.58144
_cell_length_b 5.30039
_cell_length_c 9.24889
_cell_angle_alpha 55.23524
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 224.77672
_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
Ho1 Ho 0.82513 0.27065 0.74952 1.00000
Ho2 Ho 0.17487 0.27065 0.24952 1.00000
V1 V 0.27508 0.00291 0.00080 1.00000
V2 V 0.27851 0.50357 0.49970 1.00000
V3 V 0.72492 0.00291 0.50080 1.00000
V4 V 0.72149 0.50357 0.99970 1.00000
Zn1 Zn 0.17670 0.77069 0.74710 1.00000
Zn2 Zn 0.82330 0.77069 0.24710 1.00000
O1 O 0.26293 0.85756 0.25342 1.00000
O2 O 0.57164 0.23457 0.94644 1.00000
O3 O 0.54676 0.61716 0.55461 1.00000
O4 O 0.04853 0.36698 0.94416 1.00000
O5 O 0.04663 0.74406 0.55568 1.00000
O6 O 0.78350 0.13184 0.24856 1.00000
O7 O 0.73707 0.85756 0.75342 1.00000
O8 O 0.42836 0.23457 0.44644 1.00000
O9 O 0.45324 0.61716 0.05461 1.00000
O10 O 0.95337 0.74406 0.05568 1.00000
O11 O 0.95147 0.36698 0.44416 1.00000
O12 O 0.21650 0.13184 0.74856 1.00000
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