Eu2Mn5B4
Alexandria ALEXAlex-ID: agm002201014 · 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
A2B4C5_0_spg12
Mn2B MnB Eu
2018-11-19 03:38:15
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002201014).
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 agm002201014
data_agm002201014
_cell_length_a 4.96447
_cell_length_b 5.64756
_cell_length_c 6.37399
_cell_angle_alpha 70.42152
_cell_angle_beta 66.09654
_cell_angle_gamma 64.26967
_cell_volume 144.40524
_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
Eu1 Eu 0.27999 0.82260 0.62023 1.00000
Eu2 Eu 0.72001 0.17740 0.37977 1.00000
B1 B 0.41135 0.03548 0.13897 1.00000
B2 B 0.58865 0.96452 0.86103 1.00000
B3 B 0.76899 0.64505 0.82137 1.00000
B4 B 0.23101 0.35495 0.17863 1.00000
Mn1 Mn 0.14636 0.28783 0.88991 1.00000
Mn2 Mn 0.85364 0.71217 0.11009 1.00000
Mn3 Mn 0.00000 0.50000 0.50000 1.00000
Mn4 Mn 0.67251 0.29206 0.88593 1.00000
Mn5 Mn 0.32749 0.70794 0.11407 1.00000
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