NaAgF2
Alexandria ALEXAlex-ID: agm002147488 · 空间群: P2_1/m (#11)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC2_82_spg59
NaAgF2
2018-05-28 22:37:54
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002147488).
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 agm002147488
data_agm002147488
_cell_length_a 3.35069
_cell_length_b 4.75831
_cell_length_c 7.14466
_cell_angle_alpha 85.00535
_cell_angle_beta 89.87665
_cell_angle_gamma 89.97872
_cell_volume 113.47885
_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
Na1 Na 0.18553 0.11531 0.36434 1.00000
Na2 Na 0.68655 0.64524 0.13567 1.00000
Ag1 Ag 0.68726 0.58126 0.63318 1.00000
Ag2 Ag 0.18669 0.17931 0.86683 1.00000
F1 F 0.18547 0.61551 0.36280 1.00000
F2 F 0.68394 0.08372 0.59038 1.00000
F3 F 0.68680 0.14507 0.13718 1.00000
F4 F 0.18749 0.67688 0.90961 1.00000
获取直接链接