Er2Si3Pd2
Alexandria ALEXAlex-ID: agm003309599 · 空间群: C2/m (#12)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B2C3_290_spg12
ErSiPd Er2Si3Pd Er(SiPd)2
2022-02-03 23:00:26.417445
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003309599).
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 agm003309599
data_agm003309599
_cell_length_a 4.19362
_cell_length_b 5.52640
_cell_length_c 6.37460
_cell_angle_alpha 113.49999
_cell_angle_beta 90.00000
_cell_angle_gamma 112.29757
_cell_volume 123.34263
_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
Er1 Er 0.85029 0.70058 0.22205 1.00000
Er2 Er 0.14971 0.29942 0.77795 1.00000
Si1 Si 0.50000 0.00000 0.00000 1.00000
Si2 Si 0.59857 0.19714 0.43863 1.00000
Si3 Si 0.40143 0.80286 0.56137 1.00000
Pd1 Pd 0.85689 0.71377 0.75275 1.00000
Pd2 Pd 0.14311 0.28623 0.24725 1.00000
获取直接链接