Pm2Pr2Dy5
Alexandria ALEXAlex-ID: agm008664892 · 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
A2B2C5_313_spg12
PmPr3Dy4 PrDy5 Pm3PrDy4
2024-05-15 09:55:02.163749
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm008664892).
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 agm008664892
data_agm008664892
_cell_length_a 6.24477
_cell_length_b 6.24477
_cell_length_c 14.84744
_cell_angle_alpha 69.52736
_cell_angle_beta 69.52736
_cell_angle_gamma 33.55291
_cell_volume 297.90426
_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 0.66547 0.66547 0.33393 1.00000
Pm2 Pm 0.33453 0.33453 0.66607 1.00000
Pr1 Pr 0.44557 0.44557 0.22128 1.00000
Pr2 Pr 0.55443 0.55443 0.77872 1.00000
Dy1 Dy 0.11236 0.11236 0.55462 1.00000
Dy2 Dy 0.88764 0.88764 0.44538 1.00000
Dy3 Dy 0.77594 0.77594 0.89104 1.00000
Dy4 Dy 0.22406 0.22406 0.10896 1.00000
Dy5 Dy 0.00000 0.00000 0.00000 1.00000
