Mg2Pd3Pt2
Alexandria ALEXAlex-ID: agm009773486 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_195_spg12
MgPd2 Mg2PdPt5 MgPd3
2024-03-28 19:14:05
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009773486).
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 agm009773486
data_agm009773486
_cell_length_a 4.86148
_cell_length_b 4.86148
_cell_length_c 6.34851
_cell_angle_alpha 81.94978
_cell_angle_beta 81.94978
_cell_angle_gamma 48.28278
_cell_volume 110.66918
_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
Mg1 Mg 0.57491 0.57491 0.27268 1.00000
Mg2 Mg 0.42509 0.42509 0.72732 1.00000
Pd1 Pd 0.28380 0.28380 0.14898 1.00000
Pd2 Pd 0.00000 0.00000 0.00000 1.00000
Pd3 Pd 0.71620 0.71620 0.85102 1.00000
Pt1 Pt 0.13859 0.13859 0.57180 1.00000
Pt2 Pt 0.86141 0.86141 0.42820 1.00000
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