Nd6DyTm5
Alexandria ALEXAlex-ID: agm006118727 · 空间群: Immm (#71)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB5C6_50_spg71
DyTm5 Nd
2023-09-02 06:00:59.960380
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006118727).
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 agm006118727
data_agm006118727
_cell_length_a 5.11567
_cell_length_b 10.00130
_cell_length_c 9.49559
_cell_angle_alpha 121.78851
_cell_angle_beta 105.64509
_cell_angle_gamma 89.96663
_cell_volume 391.66677
_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
Tm1 Tm 0.66693 0.16693 0.33385 1.00000
Tm2 Tm 0.33324 0.33323 0.66647 1.00000
Tm3 Tm 0.00000 0.50000 0.00000 1.00000
Tm4 Tm 0.66676 0.66677 0.33353 1.00000
Tm5 Tm 0.33307 0.83307 0.66615 1.00000
Nd1 Nd 0.83332 0.58289 0.66661 1.00000
Nd2 Nd 0.83329 0.08372 0.66661 1.00000
Nd3 Nd 0.50003 0.74920 0.00000 1.00000
Nd4 Nd 0.49997 0.25080 1.00000 1.00000
Nd5 Nd 0.16671 0.91628 0.33339 1.00000
Nd6 Nd 0.16668 0.41711 0.33339 1.00000
Dy1 Dy 0.00000 0.00000 0.00000 1.00000
获取直接链接