Tm2Np3Os2
Alexandria ALEXAlex-ID: agm009948514 · 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_21_spg12
Tm5Os2 Np TmOs2
2024-04-06 15:01:27
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009948514).
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
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# CIF generated by HEAS from Alexandria entry agm009948514
data_agm009948514
_cell_length_a 4.94750
_cell_length_b 5.83395
_cell_length_c 5.97576
_cell_angle_alpha 110.91683
_cell_angle_beta 90.04641
_cell_angle_gamma 115.06890
_cell_volume 143.56072
_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 0.15666 0.31353 0.77986 1.00000
Tm2 Tm 0.84334 0.68647 0.22014 1.00000
Np1 Np 0.50000 0.00000 0.00000 1.00000
Np2 Np 0.39743 0.79448 0.54357 1.00000
Np3 Np 0.60257 0.20552 0.45643 1.00000
Os1 Os 0.12622 0.25272 0.23428 1.00000
Os2 Os 0.87378 0.74728 0.76572 1.00000
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