Cu5Pt
Alexandria ALEXAlex-ID: agm010177516 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5_8_spg65
Cu3Pt Cu
2025-04-16 00:19:59
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010177516).
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
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# CIF generated by HEAS from Alexandria entry agm010177516
data_agm010177516
_cell_length_a 4.44091
_cell_length_b 2.70388
_cell_length_c 6.35083
_cell_angle_alpha 90.00000
_cell_angle_beta 92.16117
_cell_angle_gamma 90.00000
_cell_volume 76.20462
_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
Cu1 Cu 0.17057 0.00000 0.34094 1.00000
Cu2 Cu 0.33553 0.50000 0.66212 1.00000
Cu3 Cu 0.50000 0.00000 0.00000 1.00000
Cu4 Cu 0.66447 0.50000 0.33788 1.00000
Cu5 Cu 0.82943 0.00000 0.65906 1.00000
Pt1 Pt 0.00000 0.50000 0.00000 1.00000
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