Nd2Np3Rh2
Alexandria ALEXAlex-ID: agm009354581 · 空间群: P-1 (#2)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B2C3_6_spg65
Np NdRh
2024-03-18 02:39:36.916351
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009354581).
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 agm009354581
data_agm009354581
_cell_length_a 3.44585
_cell_length_b 5.11320
_cell_length_c 9.20090
_cell_angle_alpha 77.02520
_cell_angle_beta 81.64052
_cell_angle_gamma 92.46720
_cell_volume 155.81396
_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
Nd1 Nd 0.56155 0.81186 0.34070 1.00000
Nd2 Nd 0.43845 0.18814 0.65930 1.00000
Np1 Np 0.00000 0.00000 0.00000 1.00000
Np2 Np 0.19584 0.38604 0.09137 1.00000
Np3 Np 0.80416 0.61396 0.90863 1.00000
Rh1 Rh 0.94445 0.69959 0.62231 1.00000
Rh2 Rh 0.05555 0.30041 0.37769 1.00000
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