Ac4Pm3Ho2
Alexandria ALEXAlex-ID: agm005641785 · 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
A2B3C4_1067_spg12
Pm3Ho5 Ac Pm
2023-06-27 22:10:36.257010
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005641785).
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 agm005641785
data_agm005641785
_cell_length_a 5.40010
_cell_length_b 6.44883
_cell_length_c 11.30538
_cell_angle_alpha 74.79922
_cell_angle_beta 90.00554
_cell_angle_gamma 65.32705
_cell_volume 342.53766
_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
Ac1 Ac 0.66607 0.66791 0.88898 1.00000
Ac2 Ac 0.00313 0.99352 0.33173 1.00000
Ac3 Ac 0.99687 0.00648 0.66827 1.00000
Ac4 Ac 0.33393 0.33209 0.11102 1.00000
Pm1 Pm 0.33397 0.33214 0.44790 1.00000
Pm2 Pm 0.00000 0.00000 0.00000 1.00000
Pm3 Pm 0.66603 0.66786 0.55210 1.00000
Ho1 Ho 0.32849 0.34281 0.77224 1.00000
Ho2 Ho 0.67151 0.65719 0.22776 1.00000
获取直接链接