Dy8NpZn4
Alexandria ALEXAlex-ID: agm098188151 · 空间群: Cm (#8)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB4C8_1614_spg8
Dy2Zn Np
2025-06-22 19:47:56
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm098188151).
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 agm098188151
data_agm098188151
_cell_length_a 3.61140
_cell_length_b 11.43439
_cell_length_c 9.26877
_cell_angle_alpha 68.36371
_cell_angle_beta 78.79240
_cell_angle_gamma 80.87905
_cell_volume 347.40718
_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 0.58794 0.17031 0.19228 1.00000
Dy2 Dy 0.87860 0.73100 0.04997 1.00000
Dy3 Dy 0.55782 0.56307 0.85825 1.00000
Dy4 Dy 0.90664 0.21891 0.50454 1.00000
Dy5 Dy 0.68279 0.75088 0.42604 1.00000
Dy6 Dy 0.35749 0.50151 0.32084 1.00000
Dy7 Dy 0.20925 0.28792 0.83143 1.00000
Dy8 Dy 0.45308 0.91801 0.71454 1.00000
Np1 Np 0.23818 0.94872 0.11467 1.00000
Zn1 Zn 0.81043 0.06863 0.84939 1.00000
Zn2 Zn 0.00859 0.40318 0.11823 1.00000
Zn3 Zn 0.74200 0.46209 0.59043 1.00000
Zn4 Zn 0.06717 0.97577 0.42941 1.00000
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