Pm2Dy4Er5
Alexandria ALEXAlex-ID: agm005651609 · 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
A2B4C5_290_spg12
Dy7Er2 Pm2Dy5Er2 PmDyEr4
2023-06-22 10:08:31.535417
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005651609).
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 agm005651609
data_agm005651609
_cell_length_a 3.65699
_cell_length_b 9.88321
_cell_length_c 12.60932
_cell_angle_alpha 123.91317
_cell_angle_beta 81.68797
_cell_angle_gamma 111.71453
_cell_volume 350.23705
_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 0.89053 0.27590 0.77147 1.00000
Pm2 Pm 0.10947 0.72410 0.22853 1.00000
Dy1 Dy 0.75238 0.42423 0.34316 1.00000
Dy2 Dy 0.32157 0.35002 0.05663 1.00000
Dy3 Dy 0.24762 0.57577 0.65684 1.00000
Dy4 Dy 0.67843 0.64998 0.94337 1.00000
Er1 Er 0.92536 0.04396 0.23736 1.00000
Er2 Er 0.07464 0.95604 0.76264 1.00000
Er3 Er 0.57652 0.82552 0.49753 1.00000
Er4 Er 0.50000 0.00000 0.00000 1.00000
Er5 Er 0.42348 0.17448 0.50247 1.00000
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