Sc8Ni4Pt3Rh
Alexandria ALEXAlex-ID: agm047975053 · Space group: Pm-3m (#221)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4D8_110_spg221
Sc6Ni2PtRh3 Sc3NiPt2 Sc3Ni2Pt
2025-02-12 22:39:03
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm047975053).
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 agm047975053
data_agm047975053
_cell_length_a 6.46877
_cell_length_b 6.46877
_cell_length_c 6.46877
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 270.68571
_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
Sc1 Sc 0.24810 0.75190 0.75190 1.00000
Sc2 Sc 0.24810 0.24810 0.24810 1.00000
Sc3 Sc 0.24810 0.24810 0.75190 1.00000
Sc4 Sc 0.75190 0.24810 0.75190 1.00000
Sc5 Sc 0.24810 0.75190 0.24810 1.00000
Sc6 Sc 0.75190 0.75190 0.24810 1.00000
Sc7 Sc 0.75190 0.75190 0.75190 1.00000
Sc8 Sc 0.75190 0.24810 0.24810 1.00000
Ni1 Ni 0.50000 0.50000 0.50000 1.00000
Ni2 Ni 0.50000 0.00000 0.00000 1.00000
Ni3 Ni 0.00000 0.00000 0.50000 1.00000
Ni4 Ni 0.00000 0.50000 0.00000 1.00000
Pt1 Pt 0.50000 0.50000 0.00000 1.00000
Pt2 Pt 0.50000 0.00000 0.50000 1.00000
Pt3 Pt 0.00000 0.50000 0.50000 1.00000
Rh1 Rh 0.00000 0.00000 0.00000 1.00000
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