ZrVCo
Alexandria ALEXAlex-ID: agm003209201 · Space group: Amm2 (#38)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_47_spg38
Zr7Co3 Zr2VCo2 V3Co
2021-12-04 17:27:41.939126
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003209201).
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 agm003209201
data_agm003209201
_cell_length_a 4.96530
_cell_length_b 4.96530
_cell_length_c 8.36697
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 117.87140
_cell_volume 182.35208
_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
Zr1 Zr 0.67280 0.32720 0.31883 1.00000
Zr2 Zr 0.33671 0.66329 0.19768 1.00000
Zr3 Zr 0.33671 0.66329 0.80232 1.00000
Zr4 Zr 0.67280 0.32720 0.68117 1.00000
V1 V 0.14946 0.85054 0.50000 1.00000
V2 V 0.34066 0.16363 0.00000 1.00000
V3 V 0.83637 0.65934 0.00000 1.00000
V4 V 0.83123 0.16877 0.00000 1.00000
Co1 Co 0.00473 0.99527 0.25278 1.00000
Co2 Co 0.00473 0.99527 0.74722 1.00000
Co3 Co 0.65229 0.83734 0.50000 1.00000
Co4 Co 0.16266 0.34771 0.50000 1.00000
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