DyUF7
Alexandria ALEXAlex-ID: agm024277870 · 空间群: P2_1/c (#14)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC7_7_spg14
DyU3F15 DyF3
2024-12-31 05:30:25
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024277870).
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 agm024277870
data_agm024277870
_cell_length_a 9.30721
_cell_length_b 5.95608
_cell_length_c 12.62772
_cell_angle_alpha 90.00000
_cell_angle_beta 116.97050
_cell_angle_gamma 90.00000
_cell_volume 623.87829
_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
Dy1 Dy 0.81735 0.25375 0.73198 1.00000
Dy2 Dy 0.18265 0.75375 0.76802 1.00000
Dy3 Dy 0.18265 0.74625 0.26802 1.00000
Dy4 Dy 0.81735 0.24625 0.23198 1.00000
U1 U 0.27283 0.25424 0.54509 1.00000
U2 U 0.72717 0.75424 0.95491 1.00000
U3 U 0.72717 0.74576 0.45491 1.00000
U4 U 0.27283 0.24576 0.04509 1.00000
F1 F 0.71098 0.51552 0.08132 1.00000
F2 F 0.28902 0.01552 0.41868 1.00000
F3 F 0.28902 0.48448 0.91868 1.00000
F4 F 0.71098 0.98448 0.58132 1.00000
F5 F 0.28050 0.55287 0.44329 1.00000
F6 F 0.71950 0.05287 0.05671 1.00000
F7 F 0.71950 0.44713 0.55671 1.00000
F8 F 0.28050 0.94713 0.94329 1.00000
F9 F 0.53143 0.23803 0.14751 1.00000
F10 F 0.46857 0.73803 0.35249 1.00000
F11 F 0.46857 0.76197 0.85249 1.00000
F12 F 0.53143 0.26197 0.64751 1.00000
F13 F 0.01457 0.24531 0.93787 1.00000
F14 F 0.98543 0.74531 0.56213 1.00000
F15 F 0.98543 0.75469 0.06213 1.00000
F16 F 0.01457 0.25469 0.43787 1.00000
F17 F 0.73721 0.01563 0.33903 1.00000
F18 F 0.26279 0.51563 0.16097 1.00000
F19 F 0.26279 0.98437 0.66097 1.00000
F20 F 0.73721 0.48437 0.83903 1.00000
F21 F 0.74959 0.97834 0.82368 1.00000
F22 F 0.25041 0.47834 0.67632 1.00000
F23 F 0.25041 0.02166 0.17632 1.00000
F24 F 0.74959 0.52166 0.32368 1.00000
F25 F 0.98036 0.54788 0.75850 1.00000
F26 F 0.01964 0.04788 0.74150 1.00000
F27 F 0.01964 0.45212 0.24150 1.00000
F28 F 0.98036 0.95212 0.25850 1.00000
