Dy4CoAu
Alexandria ALEXAlex-ID: agm005808306 · 空间群: C2/c (#15)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC4_1160_spg15
Dy5Co2Au Dy2Au Dy5Co2
2023-07-28 01:26:12.669526
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005808306).
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}
}
晶体结构 3D 渲染
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# CIF generated by HEAS from Alexandria entry agm005808306
data_agm005808306
_cell_length_a 6.09936
_cell_length_b 7.39543
_cell_length_c 7.39542
_cell_angle_alpha 110.66745
_cell_angle_beta 98.23670
_cell_angle_gamma 98.23670
_cell_volume 302.05737
_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 0.91785 0.62033 0.78131 1.00000
Dy2 Dy 0.03390 0.93500 0.26831 1.00000
Dy3 Dy 0.58215 0.21869 0.37967 1.00000
Dy4 Dy 0.46610 0.73169 0.06500 1.00000
Dy5 Dy 0.53390 0.26831 0.93500 1.00000
Dy6 Dy 0.41785 0.78131 0.62033 1.00000
Dy7 Dy 0.96610 0.06500 0.73169 1.00000
Dy8 Dy 0.08215 0.37967 0.21869 1.00000
Co1 Co 0.25000 0.99839 0.00162 1.00000
Co2 Co 0.75000 0.00161 0.99838 1.00000
Au1 Au 0.75000 0.62961 0.37039 1.00000
Au2 Au 0.25000 0.37039 0.62961 1.00000
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