Tb2Pm2Pr2Y
Alexandria ALEXAlex-ID: agm024588982 · 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_136_spg164
PmPr3Y4 Pm2Pr Tb4Pm3Pr Pr
2025-05-18 02:24:22
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024588982).
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
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# CIF generated by HEAS from Alexandria entry agm024588982
data_agm024588982
_cell_length_a 6.28898
_cell_length_b 6.28898
_cell_length_c 8.11801
_cell_angle_alpha 82.55902
_cell_angle_beta 97.44098
_cell_angle_gamma 131.66753
_cell_volume 237.42126
_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 0.28568 0.71432 0.35872 1.00000
Tb2 Tb 0.71432 0.28568 0.64128 1.00000
Pm1 Pm 0.85635 0.14365 0.07159 1.00000
Pm2 Pm 0.14365 0.85635 0.92841 1.00000
Pr1 Pr 0.42799 0.57201 0.78280 1.00000
Pr2 Pr 0.57201 0.42799 0.21720 1.00000
Y1 Y 0.00000 0.00000 0.50000 1.00000
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