Hf8NiSb2
Alexandria ALEXAlex-ID: agm003530477 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_19_spg12
Hf6NiSb2 Hf
2022-03-16 03:35:26.011652
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003530477).
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 agm003530477
data_agm003530477
_cell_length_a 4.69302
_cell_length_b 5.85014
_cell_length_c 9.32363
_cell_angle_alpha 106.51044
_cell_angle_beta 104.57657
_cell_angle_gamma 90.00000
_cell_volume 236.81810
_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
Hf1 Hf 0.41338 0.50517 0.82676 1.00000
Hf2 Hf 0.64329 0.04338 0.28659 1.00000
Hf3 Hf 0.77241 0.66168 0.54481 1.00000
Hf4 Hf 0.97884 0.23201 0.95768 1.00000
Hf5 Hf 0.22759 0.33832 0.45519 1.00000
Hf6 Hf 0.35671 0.95662 0.71341 1.00000
Hf7 Hf 0.58662 0.49483 0.17324 1.00000
Hf8 Hf 0.02116 0.76799 0.04232 1.00000
Ni1 Ni 0.50000 0.00000 0.00000 1.00000
Sb1 Sb 0.81719 0.22002 0.63438 1.00000
Sb2 Sb 0.18281 0.77998 0.36562 1.00000
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