RbN2
Alexandria ALEXAlex-ID: agm005541363 · 空间群: Cmcm (#63)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB2_681_spg139
RbN3 Rb
2023-05-28 14:22:36.578674
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005541363).
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 agm005541363
data_agm005541363
_cell_length_a 4.66504
_cell_length_b 7.75781
_cell_length_c 6.24306
_cell_angle_alpha 67.00066
_cell_angle_beta 48.36611
_cell_angle_gamma 53.45116
_cell_volume 135.65579
_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 0.25077 0.75001 0.24559 1.00000
Rb2 Rb 0.74923 0.24999 0.75441 1.00000
N1 N 0.08217 0.74998 0.82878 1.00000
N2 N 0.57994 0.25019 0.33921 1.00000
N3 N 0.42006 0.74981 0.66079 1.00000
N4 N 0.91783 0.25002 0.17122 1.00000
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