Ce2Pm3Pb4
Alexandria ALEXAlex-ID: agm005685679 · 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_360_spg12
Pm5Pb4 Ce5Pb4
2023-06-26 21:30:06.440536
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005685679).
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 agm005685679
data_agm005685679
_cell_length_a 4.99018
_cell_length_b 6.88991
_cell_length_c 10.01980
_cell_angle_alpha 119.01378
_cell_angle_beta 104.41924
_cell_angle_gamma 90.00015
_cell_volume 288.79360
_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 0.66480 0.24656 0.32959 1.00000
Ce2 Ce 0.33520 0.75344 0.67041 1.00000
Pm1 Pm 0.11143 0.64755 0.22286 1.00000
Pm2 Pm 0.88857 0.35245 0.77714 1.00000
Pm3 Pm 0.00000 0.00000 0.00000 1.00000
Pb1 Pb 0.50516 0.72614 0.01033 1.00000
Pb2 Pb 0.25681 0.19506 0.51363 1.00000
Pb3 Pb 0.49484 0.27386 0.98967 1.00000
Pb4 Pb 0.74319 0.80494 0.48637 1.00000
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