Nd2Dy3Ho6Er
Alexandria ALEXAlex-ID: agm004657948 · 空间群: C2/m (#12)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB2C3D6_178_spg12
Nd(DyHo3)2 Nd2DyHo6 NdDy4Ho HoEr5
2022-06-28 02:34:12.622302
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004657948).
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
加载 3D 结构...
# CIF generated by HEAS from Alexandria entry agm004657948
data_agm004657948
_cell_length_a 6.15087
_cell_length_b 6.15087
_cell_length_c 11.76280
_cell_angle_alpha 94.98202
_cell_angle_beta 94.98202
_cell_angle_gamma 119.96251
_cell_volume 379.69488
_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
Nd1 Nd 0.33351 0.66649 0.00000 1.00000
Nd2 Nd 0.66649 0.33351 0.00000 1.00000
Dy1 Dy 0.16650 0.83350 0.50000 1.00000
Dy2 Dy 0.83350 0.16650 0.50000 1.00000
Dy3 Dy 0.50000 0.50000 0.50000 1.00000
Ho1 Ho 0.91549 0.58299 0.74782 1.00000
Ho2 Ho 0.75224 0.75224 0.25256 1.00000
Ho3 Ho 0.08451 0.41701 0.25218 1.00000
Ho4 Ho 0.58299 0.91549 0.74782 1.00000
Ho5 Ho 0.24776 0.24776 0.74744 1.00000
Ho6 Ho 0.41701 0.08451 0.25218 1.00000
Er1 Er 0.00000 0.00000 0.00000 1.00000
获取直接链接