Er3TmTe5
Alexandria ALEXAlex-ID: agm072255387 · 空间群: P1 (#1)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB3C5_1242_spg1
Er5Te6 Tm3Te4 Er3Te4
2024-09-25 00:11:49.684954
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072255387).
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 agm072255387
data_agm072255387
_cell_length_a 7.07921
_cell_length_b 7.18479
_cell_length_c 7.68621
_cell_angle_alpha 70.69603
_cell_angle_beta 79.87624
_cell_angle_gamma 66.52481
_cell_volume 337.98403
_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
Er1 Er 0.75761 0.93666 0.92280 1.00000
Er2 Er 0.21782 0.13452 0.89022 1.00000
Er3 Er 0.58257 0.48993 0.89980 1.00000
Tm1 Tm 0.17574 0.92687 0.47984 1.00000
Te1 Te 0.13717 0.59629 0.82394 1.00000
Te2 Te 0.86840 0.11416 0.17932 1.00000
Te3 Te 0.53688 0.92700 0.62093 1.00000
Te4 Te 0.47768 0.73686 0.18821 1.00000
Te5 Te 0.88335 0.28250 0.61919 1.00000
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