Rb2PuSnTe4
Alexandria ALEXAlex-ID: agm004820060 · 空间群: P2/m (#10)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC2D4_343_spg10
PuTe3 Rb4SnTe4 RbPuTe2 SnTe
2022-07-19 12:33:25.472139
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004820060).
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 agm004820060
data_agm004820060
_cell_length_a 4.60936
_cell_length_b 8.80327
_cell_length_c 8.09513
_cell_angle_alpha 72.83023
_cell_angle_beta 89.99975
_cell_angle_gamma 89.99970
_cell_volume 313.84033
_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
Rb1 Rb 0.00000 0.00000 1.00000 1.00000
Rb2 Rb 0.50000 0.00000 0.50000 1.00000
Pu1 Pu 0.00000 0.49999 0.50000 1.00000
Sn1 Sn 0.50000 0.50000 1.00000 1.00000
Te1 Te 0.00000 0.69626 0.75782 1.00000
Te2 Te 1.00000 0.30374 0.24217 1.00000
Te3 Te 0.50000 0.69525 0.27427 1.00000
Te4 Te 0.50000 0.30475 0.72573 1.00000
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