U8P4Rh
Alexandria ALEXAlex-ID: agm097990201 · 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
AB4C8_692_spg1
UP U2P URh
2025-06-18 04:30:20
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097990201).
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 agm097990201
data_agm097990201
_cell_length_a 3.69769
_cell_length_b 8.41560
_cell_length_c 8.52642
_cell_angle_alpha 69.53925
_cell_angle_beta 85.74233
_cell_angle_gamma 94.21305
_cell_volume 246.49504
_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 0.70520 0.14717 0.18351 1.00000
U2 U 0.67087 0.69768 0.22842 1.00000
U3 U 0.61604 0.63046 0.66241 1.00000
U4 U 0.50716 0.24392 0.57532 1.00000
U5 U 0.39083 0.86091 0.39991 1.00000
U6 U 0.22801 0.31513 0.27403 1.00000
U7 U 0.26268 0.34199 0.82906 1.00000
U8 U 0.31417 0.76854 0.84599 1.00000
P1 P 0.23293 0.96238 0.06409 1.00000
P2 P 0.77074 0.49735 0.00662 1.00000
P3 P 0.09316 0.51363 0.47347 1.00000
P4 P 0.92028 0.97963 0.59207 1.00000
Rh1 Rh 0.78794 0.04120 0.86511 1.00000
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