Mn3Pt5
Alexandria ALEXAlex-ID: agm007902090 · Space group: I-4m2 (#119)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B5_14_spg119
Mn3Pt5
2024-03-17 12:58:23.676686
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007902090).
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 agm007902090
data_agm007902090
_cell_length_a 8.46509
_cell_length_b 8.46509
_cell_length_c 8.46509
_cell_angle_alpha 153.46512
_cell_angle_beta 153.46512
_cell_angle_gamma 37.87751
_cell_volume 120.87519
_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
Mn1 Mn 0.37146 0.87146 0.50000 1.00000
Mn2 Mn 0.12854 0.62854 0.50000 1.00000
Mn3 Mn 0.50000 0.50000 0.00000 1.00000
Pt1 Pt 0.87640 0.37640 0.50000 1.00000
Pt2 Pt 0.24871 0.24871 0.00000 1.00000
Pt3 Pt 0.62360 0.12360 0.50000 1.00000
Pt4 Pt 0.00000 0.00000 0.00000 1.00000
Pt5 Pt 0.75129 0.75129 0.00000 1.00000
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