La2Pt
Alexandria ALEXAlex-ID: agm005483082 · 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
AB2_4_spg12
La4Pt3 La7Pt3
2023-03-21 09:31:13.800314
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005483082).
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 agm005483082
data_agm005483082
_cell_length_a 6.85665
_cell_length_b 6.85665
_cell_length_c 7.37295
_cell_angle_alpha 78.78351
_cell_angle_beta 78.78351
_cell_angle_gamma 31.59603
_cell_volume 177.85897
_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
La1 La 0.13963 0.13963 0.90114 1.00000
La2 La 0.86037 0.86037 0.09886 1.00000
La3 La 0.11952 0.11952 0.43735 1.00000
La4 La 0.88048 0.88048 0.56265 1.00000
Pt1 Pt 0.52700 0.52700 0.20207 1.00000
Pt2 Pt 0.47300 0.47300 0.79793 1.00000
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