ErMn2Ni5
Alexandria ALEXAlex-ID: agm003476151 · 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
AB2C5_53_spg71
Mn3Ni5 ErNi3 Mn
2022-02-21 04:32:51.972481
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003476151).
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 agm003476151
data_agm003476151
_cell_length_a 3.62910
_cell_length_b 6.00942
_cell_length_c 6.00942
_cell_angle_alpha 66.37834
_cell_angle_beta 72.42519
_cell_angle_gamma 72.42519
_cell_volume 111.98863
_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
Er1 Er 0.00000 0.00000 0.00000 1.00000
Mn1 Mn 0.75260 0.74740 0.74740 1.00000
Mn2 Mn 0.24740 0.25260 0.25260 1.00000
Ni1 Ni 0.00000 0.50000 0.50000 1.00000
Ni2 Ni 0.63369 0.55594 0.17668 1.00000
Ni3 Ni 0.36631 0.44406 0.82332 1.00000
Ni4 Ni 0.36631 0.82332 0.44406 1.00000
Ni5 Ni 0.63369 0.17668 0.55594 1.00000
获取直接链接