V2FeNi
Alexandria ALEXAlex-ID: agm005804048 · Space group: P2_1/m (#11)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2_1005_spg63
V5Fe3 VFe3 VNi2
2023-07-14 18:12:22.296927
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005804048).
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 agm005804048
data_agm005804048
_cell_length_a 2.53207
_cell_length_b 4.14268
_cell_length_c 9.26533
_cell_angle_alpha 90.00005
_cell_angle_beta 96.19083
_cell_angle_gamma 89.99657
_cell_volume 96.62235
_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 0.07948 0.24996 0.70868 1.00000
V2 V 0.92052 0.75004 0.29132 1.00000
V3 V 0.64513 0.25001 0.43569 1.00000
V4 V 0.35487 0.74999 0.56431 1.00000
Fe1 Fe 0.27158 0.25004 0.19122 1.00000
Fe2 Fe 0.72842 0.74996 0.80878 1.00000
Ni1 Ni 0.71543 0.24999 0.96088 1.00000
Ni2 Ni 0.28457 0.75001 0.03912 1.00000
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