SbPt
Alexandria ALEXAlex-ID: agm005432069 · 空间群: Cm (#8)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB_1555_spg8
SbPt
2023-03-21 19:37:26.971221
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005432069).
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 agm005432069
data_agm005432069
_cell_length_a 5.67858
_cell_length_b 5.67858
_cell_length_c 7.28128
_cell_angle_alpha 57.97244
_cell_angle_beta 57.97244
_cell_angle_gamma 39.40095
_cell_volume 123.13974
_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
Sb1 Sb 0.63184 0.63184 0.68150 1.00000
Sb2 Sb 0.02581 0.02581 0.39542 1.00000
Sb3 Sb 0.79214 0.79214 0.02623 1.00000
Pt1 Pt 0.04585 0.04585 0.00870 1.00000
Pt2 Pt 0.30717 0.30717 0.34859 1.00000
Pt3 Pt 0.36386 0.36386 0.70622 1.00000
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