Tb2Ho2ErTl2
Alexandria ALEXAlex-ID: agm024411903 · 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
AB2C2D2_46_spg12
Tb3Er2Tl3 Ho7Er2 Ho9Tl4 Tb5Tl3
2025-05-09 03:38:47
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024411903).
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 agm024411903
data_agm024411903
_cell_length_a 6.82153
_cell_length_b 6.82153
_cell_length_c 8.57896
_cell_angle_alpha 80.27110
_cell_angle_beta 99.72890
_cell_angle_gamma 148.52850
_cell_volume 205.17878
_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 0.26280 0.73720 0.83769 1.00000
Tb2 Tb 0.73720 0.26280 0.16231 1.00000
Ho1 Ho 0.86592 0.13408 0.55761 1.00000
Ho2 Ho 0.13408 0.86592 0.44239 1.00000
Er1 Er 0.00000 0.00000 0.00000 1.00000
Tl1 Tl 0.44160 0.55840 0.26897 1.00000
Tl2 Tl 0.55840 0.44160 0.73103 1.00000
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