V8Ni2C
Alexandria ALEXAlex-ID: agm003530366 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_321_spg12
V3Ni V2C
2022-03-13 20:57:42.892925
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003530366).
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 agm003530366
data_agm003530366
_cell_length_a 4.02417
_cell_length_b 5.10111
_cell_length_c 7.77957
_cell_angle_alpha 117.44146
_cell_angle_beta 104.98922
_cell_angle_gamma 90.00000
_cell_volume 135.57616
_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 0.41132 0.52583 0.82264 1.00000
V2 V 0.63041 0.02084 0.26083 1.00000
V3 V 0.78367 0.64833 0.56733 1.00000
V4 V 0.99329 0.23594 0.98657 1.00000
V5 V 0.21633 0.35167 0.43267 1.00000
V6 V 0.36959 0.97916 0.73917 1.00000
V7 V 0.58868 0.47417 0.17736 1.00000
V8 V 0.00671 0.76406 0.01343 1.00000
Ni1 Ni 0.81402 0.19537 0.62804 1.00000
Ni2 Ni 0.18598 0.80463 0.37196 1.00000
C1 C 0.50000 0.00000 0.00000 1.00000
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