PmErNi
Alexandria ALEXAlex-ID: agm003598751 · 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
ABC_668_spg12
ErNi Pm
2022-03-09 04:23:18.921131
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003598751).
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 agm003598751
data_agm003598751
_cell_length_a 3.42643
_cell_length_b 6.95210
_cell_length_c 6.68653
_cell_angle_alpha 105.50465
_cell_angle_beta 104.88853
_cell_angle_gamma 89.95578
_cell_volume 147.93479
_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
Pm1 Pm 0.30970 0.48749 0.38555 1.00000
Pm2 Pm 0.56786 0.61636 0.90326 1.00000
Er1 Er 0.57005 0.11652 0.90660 1.00000
Er2 Er 0.30770 0.98736 0.38223 1.00000
Ni1 Ni 0.94194 0.27353 0.65028 1.00000
Ni2 Ni 0.93624 0.83053 0.63860 1.00000
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