Tb3(CuGe)2
Alexandria ALEXAlex-ID: agm010020780 · 空间群: Immm (#71)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B2C3_1746_spg12
Tb4Ge3 TbCuGe TbCu2
2024-03-25 04:03:01.643676
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010020780).
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}
}
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# CIF generated by HEAS from Alexandria entry agm010020780
data_agm010020780
_cell_length_a 9.31831
_cell_length_b 9.31831
_cell_length_c 9.31831
_cell_angle_alpha 154.62841
_cell_angle_beta 154.09437
_cell_angle_gamma 36.57642
_cell_volume 151.26500
_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
Tb1 Tb 0.00000 0.00000 0.00000 1.00000
Tb2 Tb 0.31785 0.81785 0.50000 1.00000
Tb3 Tb 0.68215 0.18215 0.50000 1.00000
Cu1 Cu 0.43321 0.43321 0.00000 1.00000
Cu2 Cu 0.56679 0.56679 0.00000 1.00000
Ge1 Ge 0.85547 0.35547 0.50000 1.00000
Ge2 Ge 0.14453 0.64453 0.50000 1.00000
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