Pm2Pr2SmDy2
Alexandria ALEXAlex-ID: agm024291893 · 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
AB2C2D2_136_spg164
Pm2Pr Pm3PrDy4 PrSm4 Pr
2025-05-26 12:53:07
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024291893).
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 agm024291893
data_agm024291893
_cell_length_a 6.28705
_cell_length_b 6.28705
_cell_length_c 8.12562
_cell_angle_alpha 82.60783
_cell_angle_beta 97.39217
_cell_angle_gamma 131.67456
_cell_volume 237.50424
_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 0.28636 0.71364 0.35479 1.00000
Pm2 Pm 0.71364 0.28636 0.64521 1.00000
Pr1 Pr 0.42815 0.57185 0.78670 1.00000
Pr2 Pr 0.57185 0.42815 0.21330 1.00000
Sm1 Sm 0.00000 0.00000 0.50000 1.00000
Dy1 Dy 0.85674 0.14326 0.07041 1.00000
Dy2 Dy 0.14326 0.85674 0.92959 1.00000
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