TbCoCu
Alexandria ALEXAlex-ID: agm005604231 · 空间群: Imma (#74)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC_13_spg8
Tb2Co3 TbCo3 TbCu2
2023-06-17 05:27:48.147464
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005604231).
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 agm005604231
data_agm005604231
_cell_length_a 3.85279
_cell_length_b 4.04737
_cell_length_c 7.54999
_cell_angle_alpha 105.54757
_cell_angle_beta 104.64762
_cell_angle_gamma 89.99999
_cell_volume 109.44719
_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 0.63379 0.88354 0.76707 1.00000
Tb2 Tb 0.36621 0.11646 0.23293 1.00000
Co1 Co 0.21525 0.46495 0.92990 1.00000
Co2 Co 0.78475 0.53505 0.07010 1.00000
Cu1 Cu 0.04690 0.29594 0.59189 1.00000
Cu2 Cu 0.95310 0.70406 0.40811 1.00000
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