Dy8CuPt6
Alexandria ALEXAlex-ID: agm072916072 · Space group: R-3 (#148)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_38_spg148
Dy5Pt3 Dy2CuPt DyPt
2024-10-05 23:14:24.411663
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072916072).
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 agm072916072
data_agm072916072
_cell_length_a 7.61438
_cell_length_b 7.61438
_cell_length_c 7.61438
_cell_angle_alpha 67.41903
_cell_angle_beta 67.41903
_cell_angle_gamma 67.41903
_cell_volume 361.60153
_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
Dy1 Dy 0.32860 0.32860 0.32860 1.00000
Dy2 Dy 0.67140 0.67140 0.67140 1.00000
Dy3 Dy 0.81140 0.11702 0.38233 1.00000
Dy4 Dy 0.38233 0.81140 0.11702 1.00000
Dy5 Dy 0.11702 0.38233 0.81140 1.00000
Dy6 Dy 0.18860 0.88298 0.61767 1.00000
Dy7 Dy 0.61767 0.18860 0.88298 1.00000
Dy8 Dy 0.88298 0.61767 0.18860 1.00000
Cu1 Cu 0.00000 0.00000 0.00000 1.00000
Pt1 Pt 0.05823 0.70137 0.43419 1.00000
Pt2 Pt 0.43419 0.05823 0.70137 1.00000
Pt3 Pt 0.70137 0.43419 0.05823 1.00000
Pt4 Pt 0.94177 0.29863 0.56581 1.00000
Pt5 Pt 0.56581 0.94177 0.29863 1.00000
Pt6 Pt 0.29863 0.56581 0.94177 1.00000
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