Pm(Ga3Ni)4
Alexandria ALEXAlex-ID: agm003590337 · Space group: Im-3 (#204)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C12_14_spg204
Pm2Ga12Ni Ga7Ni3 Ga3Ni2
2022-04-04 01:40:10.585538
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003590337).
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 agm003590337
data_agm003590337
_cell_length_a 7.41892
_cell_length_b 7.41892
_cell_length_c 7.41892
_cell_angle_alpha 109.47122
_cell_angle_beta 109.47122
_cell_angle_gamma 109.47122
_cell_volume 314.34093
_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
Pm1 Pm 0.00000 0.00000 0.00000 1.00000
Ga1 Ga 0.82664 0.33861 0.16525 1.00000
Ga2 Ga 0.33861 0.51198 0.17336 1.00000
Ga3 Ga 0.83475 0.17336 0.66139 1.00000
Ga4 Ga 0.33861 0.16525 0.82664 1.00000
Ga5 Ga 0.16525 0.82664 0.33861 1.00000
Ga6 Ga 0.66139 0.48802 0.82664 1.00000
Ga7 Ga 0.51198 0.17336 0.33861 1.00000
Ga8 Ga 0.48802 0.82664 0.66139 1.00000
Ga9 Ga 0.66139 0.83475 0.17336 1.00000
Ga10 Ga 0.82664 0.66139 0.48802 1.00000
Ga11 Ga 0.17336 0.33861 0.51198 1.00000
Ga12 Ga 0.17336 0.66139 0.83475 1.00000
Ni1 Ni 0.00000 0.50000 0.00000 1.00000
Ni2 Ni 0.50000 0.00000 0.00000 1.00000
Ni3 Ni 0.50000 0.50000 0.50000 1.00000
Ni4 Ni 0.00000 0.00000 0.50000 1.00000
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