Ce3Pm5Co
Alexandria ALEXAlex-ID: agm072518136 · 空间群: Cm (#8)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB3C5_1363_spg8
Ce Pm CeCo
2024-09-24 03:13:57.773158
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072518136).
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
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# CIF generated by HEAS from Alexandria entry agm072518136
data_agm072518136
_cell_length_a 6.31985
_cell_length_b 6.31985
_cell_length_c 8.86825
_cell_angle_alpha 61.72067
_cell_angle_beta 61.72067
_cell_angle_gamma 69.58862
_cell_volume 271.14709
_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
Ce1 Ce 0.01578 0.58110 0.62280 1.00000
Ce2 Ce 0.58110 0.01578 0.62280 1.00000
Ce3 Ce 0.64219 0.64219 0.41648 1.00000
Pm1 Pm 0.16891 0.16891 0.41658 1.00000
Pm2 Pm 0.42184 0.42184 0.89421 1.00000
Pm3 Pm 0.79388 0.27781 0.15412 1.00000
Pm4 Pm 0.90232 0.90232 0.89870 1.00000
Pm5 Pm 0.27781 0.79388 0.15412 1.00000
Co1 Co 0.19994 0.19994 0.82051 1.00000
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