Na3(PmCo)2
Alexandria ALEXAlex-ID: agm009609459 · 空间群: R-3m (#166)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B2C3_1807_spg12
Na PmCo
2024-11-07 23:26:27.691918
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009609459).
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 agm009609459
data_agm009609459
_cell_length_a 3.92238
_cell_length_b 3.92238
_cell_length_c 16.38163
_cell_angle_alpha 82.88614
_cell_angle_beta 82.88614
_cell_angle_gamma 60.02527
_cell_volume 216.07751
_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
Na1 Na 0.72598 0.72598 0.31236 1.00000
Na2 Na 0.00000 0.00000 0.50000 1.00000
Na3 Na 0.27402 0.27402 0.68764 1.00000
Pm1 Pm 0.46055 0.46055 0.11427 1.00000
Pm2 Pm 0.53945 0.53945 0.88573 1.00000
Co1 Co 0.16651 0.16651 0.00011 1.00000
Co2 Co 0.83349 0.83349 0.99989 1.00000
获取直接链接