SrZn2
Alexandria ALEXAlex-ID: agm003196462 · 空间群: Cm (#8)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB2_1935_spg8
SrZn2
2021-12-03 05:59:36.103809
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003196462).
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 agm003196462
data_agm003196462
_cell_length_a 6.30513
_cell_length_b 6.30513
_cell_length_c 6.62727
_cell_angle_alpha 105.69282
_cell_angle_beta 105.69282
_cell_angle_gamma 39.92819
_cell_volume 161.94578
_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
Sr1 Sr 0.02832 0.02832 0.03602 1.00000
Sr2 Sr 0.68146 0.68146 0.61915 1.00000
Zn1 Zn 0.36045 0.36045 0.23610 1.00000
Zn2 Zn 0.40781 0.40781 0.65941 1.00000
Zn3 Zn 0.94394 0.94394 0.47605 1.00000
Zn4 Zn 0.74469 0.74469 0.13993 1.00000
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