RbGeTe
Alexandria ALEXAlex-ID: agm003608963 · 空间群: C2 (#5)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC_790_spg1
Rb4GeTe4 Ge
2022-03-07 02:27:55.036407
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003608963).
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 agm003608963
data_agm003608963
_cell_length_a 5.54170
_cell_length_b 9.02785
_cell_length_c 6.49608
_cell_angle_alpha 128.02957
_cell_angle_beta 115.17514
_cell_angle_gamma 90.13009
_cell_volume 215.16428
_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 0.76200 0.51134 0.19497 1.00000
Rb2 Rb 0.23932 0.21652 0.14953 1.00000
Ge1 Ge 0.32367 0.79521 0.14015 1.00000
Ge2 Ge 0.85594 0.93274 0.20413 1.00000
Te1 Te 0.47689 0.86418 0.67229 1.00000
Te2 Te 0.00555 0.36416 0.67248 1.00000
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