RbLi2SnF8
Alexandria ALEXAlex-ID: agm004881702 · 空间群: P-1 (#2)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC2D8_353_spg2
RbLiSnF6 RbF3 Li2SnF6 LiF
2023-01-01 22:26:22.446819
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004881702).
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 agm004881702
data_agm004881702
_cell_length_a 4.81473
_cell_length_b 4.79684
_cell_length_c 8.01897
_cell_angle_alpha 86.34382
_cell_angle_beta 91.31664
_cell_angle_gamma 88.79103
_cell_volume 184.72904
_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
Rb1 Rb 0.00000 0.00000 0.50000 1.00000
Li1 Li 0.50556 0.52171 0.81536 1.00000
Li2 Li 0.49444 0.47829 0.18464 1.00000
Sn1 Sn 0.00000 0.00000 0.00000 1.00000
F1 F 0.20090 0.77626 0.18705 1.00000
F2 F 0.69747 0.71509 0.00255 1.00000
F3 F 0.81042 0.20022 0.17744 1.00000
F4 F 0.79910 0.22374 0.81295 1.00000
F5 F 0.30253 0.28491 0.99745 1.00000
F6 F 0.18958 0.79978 0.82256 1.00000
F7 F 0.52987 0.65231 0.57610 1.00000
F8 F 0.47013 0.34769 0.42390 1.00000
获取直接链接