U13Co7Ru4
Alexandria ALEXAlex-ID: agm008595083 · 空间群: P1 (#1)
基础信息
组成
能量与稳定性
电子结构
其他信息
A4B7C13_8_spg1
U4Ru3 U2Ru UCo
2024-07-09 02:03:51.960859
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm008595083).
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 agm008595083
data_agm008595083
_cell_length_a 7.76092
_cell_length_b 7.78370
_cell_length_c 7.97366
_cell_angle_alpha 69.54817
_cell_angle_beta 76.28079
_cell_angle_gamma 68.04689
_cell_volume 415.43399
_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
U1 U 0.68343 0.28063 0.83709 1.00000
U2 U 0.06700 0.04368 0.77849 1.00000
U3 U 0.79807 0.87480 0.20067 1.00000
U4 U 0.17596 0.73778 0.18191 1.00000
U5 U 0.81839 0.19092 0.22900 1.00000
U6 U 0.16808 0.10016 0.05136 1.00000
U7 U 0.63308 0.65050 0.64305 1.00000
U8 U 0.64196 0.57769 0.07608 1.00000
U9 U 0.29368 0.63616 0.62178 1.00000
U10 U 0.68786 0.10557 0.58584 1.00000
U11 U 0.37182 0.13026 0.36959 1.00000
U12 U 0.04889 0.35674 0.49686 1.00000
U13 U 0.32988 0.47030 0.97133 1.00000
Co1 Co 0.41534 0.42666 0.36715 1.00000
Co2 Co 0.33896 0.26800 0.72587 1.00000
Co3 Co 0.69646 0.47462 0.42665 1.00000
Co4 Co 0.46120 0.79994 0.29526 1.00000
Co5 Co 0.00329 0.47576 0.16643 1.00000
Co6 Co 0.52931 0.03031 0.99123 1.00000
Co7 Co 0.12583 0.99021 0.42757 1.00000
Ru1 Ru 0.88888 0.80162 0.88230 1.00000
Ru2 Ru 0.93157 0.75765 0.52835 1.00000
Ru3 Ru 0.43336 0.87919 0.80561 1.00000
Ru4 Ru 0.95771 0.44085 0.84054 1.00000
