Tm2Np3Fe2
Alexandria ALEXAlex-ID: agm010060436 · 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_100_spg12
Tm3(NpFe2)2 Tm Np
2024-03-04 15:11:19.620740
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010060436).
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 agm010060436
data_agm010060436
_cell_length_a 6.49489
_cell_length_b 6.49489
_cell_length_c 8.04958
_cell_angle_alpha 53.41960
_cell_angle_beta 53.41960
_cell_angle_gamma 31.30803
_cell_volume 138.59433
_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
Tm1 Tm 0.38133 0.38133 0.26951 1.00000
Tm2 Tm 0.61867 0.61867 0.73049 1.00000
Np1 Np 0.66588 0.66588 0.22898 1.00000
Np2 Np 0.00000 0.00000 0.50000 1.00000
Np3 Np 0.33412 0.33412 0.77102 1.00000
Fe1 Fe 0.88878 0.88878 0.97868 1.00000
Fe2 Fe 0.11122 0.11122 0.02132 1.00000
获取直接链接