Tb7Mg3Ge8
Alexandria ALEXAlex-ID: agm003243772 · 空间群: P2_1 (#4)
基础信息
组成
能量与稳定性
电子结构
其他信息
A3B7C8_0_spg4
Tb3Ge5 Tb2MgGe2 Mg2Ge
2022-01-03 17:24:15
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003243772).
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 agm003243772
data_agm003243772
_cell_length_a 7.16163
_cell_length_b 7.81003
_cell_length_c 14.55801
_cell_angle_alpha 89.98924
_cell_angle_beta 90.00010
_cell_angle_gamma 89.99995
_cell_volume 814.26701
_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
Mg1 Mg 0.15730 0.76551 0.49828 1.00000
Mg2 Mg 0.65731 0.23449 0.50172 1.00000
Mg3 Mg 0.83974 0.72768 0.99938 1.00000
Mg4 Mg 0.33974 0.27232 0.00062 1.00000
Mg5 Mg 0.32260 0.42586 0.62553 1.00000
Mg6 Mg 0.82260 0.57414 0.37447 1.00000
Tb1 Tb 0.49160 0.93362 0.65246 1.00000
Tb2 Tb 0.99161 0.06638 0.34754 1.00000
Tb3 Tb 0.51235 0.56664 0.15711 1.00000
Tb4 Tb 0.01235 0.43336 0.84290 1.00000
Tb5 Tb 0.50902 0.56531 0.84135 1.00000
Tb6 Tb 0.00902 0.43469 0.15865 1.00000
Tb7 Tb 0.48957 0.93540 0.34874 1.00000
Tb8 Tb 0.98957 0.06460 0.65126 1.00000
Tb9 Tb 0.67169 0.07207 0.12533 1.00000
Tb10 Tb 0.17169 0.92793 0.87467 1.00000
Tb11 Tb 0.67051 0.07328 0.87515 1.00000
Tb12 Tb 0.17051 0.92672 0.12484 1.00000
Tb13 Tb 0.33060 0.43089 0.38076 1.00000
Tb14 Tb 0.83060 0.56911 0.61924 1.00000
Ge1 Ge 0.28615 0.11064 0.50035 1.00000
Ge2 Ge 0.78616 0.88935 0.49967 1.00000
Ge3 Ge 0.71411 0.38843 0.99970 1.00000
Ge4 Ge 0.21412 0.61157 0.00028 1.00000
Ge5 Ge 0.52613 0.65746 0.50026 1.00000
Ge6 Ge 0.02613 0.34255 0.49976 1.00000
Ge7 Ge 0.47832 0.83639 0.99952 1.00000
Ge8 Ge 0.97832 0.16361 0.00046 1.00000
Ge9 Ge 0.33206 0.21828 0.78337 1.00000
Ge10 Ge 0.83206 0.78172 0.21662 1.00000
Ge11 Ge 0.67144 0.28539 0.29036 1.00000
Ge12 Ge 0.17144 0.71461 0.70965 1.00000
Ge13 Ge 0.66531 0.28463 0.71123 1.00000
Ge14 Ge 0.16531 0.71537 0.28878 1.00000
Ge15 Ge 0.33150 0.21764 0.21623 1.00000
Ge16 Ge 0.83150 0.78236 0.78377 1.00000
