Li4Ge2Pt3
Alexandria ALEXAlex-ID: agm005653418 · 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
A2B3C4_139_spg2
Li3GePt2 Li4Ge6Pt7 Li3(GePt)2
2023-06-27 09:30:24.769436
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005653418).
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 agm005653418
data_agm005653418
_cell_length_a 4.18186
_cell_length_b 5.15505
_cell_length_c 6.90131
_cell_angle_alpha 81.69141
_cell_angle_beta 72.36357
_cell_angle_gamma 66.07076
_cell_volume 129.55689
_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
Li1 Li 0.66085 0.55988 0.11843 1.00000
Li2 Li 0.99968 0.34321 0.65744 1.00000
Li3 Li 0.00032 0.65679 0.34256 1.00000
Li4 Li 0.33915 0.44012 0.88157 1.00000
Ge1 Ge 0.33754 0.09179 0.23312 1.00000
Ge2 Ge 0.66246 0.90821 0.76688 1.00000
Pt1 Pt 0.32513 0.78517 0.56457 1.00000
Pt2 Pt 0.00000 0.00000 0.00000 1.00000
Pt3 Pt 0.67487 0.21483 0.43543 1.00000
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