Pm6AlCo8
Alexandria ALEXAlex-ID: agm072901049 · 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
AB6C8_608_spg12
Pm2Co17 AlCo PmCo
2024-10-05 05:35:00.762821
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072901049).
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 agm072901049
data_agm072901049
_cell_length_a 8.00808
_cell_length_b 8.00808
_cell_length_c 7.79015
_cell_angle_alpha 65.59949
_cell_angle_beta 65.59949
_cell_angle_gamma 39.41092
_cell_volume 285.00291
_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 0.69128 0.69128 0.94714 1.00000
Pm2 Pm 0.47170 0.47170 0.31569 1.00000
Pm3 Pm 0.82446 0.82446 0.34665 1.00000
Pm4 Pm 0.30872 0.30872 0.05286 1.00000
Pm5 Pm 0.52830 0.52830 0.68431 1.00000
Pm6 Pm 0.17554 0.17554 0.65335 1.00000
Al1 Al 0.00000 0.00000 0.50000 1.00000
Co1 Co 0.87847 0.41976 0.32685 1.00000
Co2 Co 0.12153 0.58024 0.67315 1.00000
Co3 Co 0.41976 0.87847 0.32685 1.00000
Co4 Co 0.91698 0.91698 0.84893 1.00000
Co5 Co 0.21514 0.78486 0.00000 1.00000
Co6 Co 0.58024 0.12153 0.67315 1.00000
Co7 Co 0.08302 0.08302 0.15107 1.00000
Co8 Co 0.78486 0.21514 0.00000 1.00000
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