Ho2Er2ScPd2
Alexandria ALEXAlex-ID: agm024265328 · 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_69_spg12
Er2Pd Ho3Pd Ho7Er2 Sc2Pd
2025-05-22 14:40:19
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024265328).
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 agm024265328
data_agm024265328
_cell_length_a 6.36277
_cell_length_b 6.36277
_cell_length_c 8.72903
_cell_angle_alpha 64.68486
_cell_angle_beta 115.31514
_cell_angle_gamma 146.63855
_cell_volume 173.90160
_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
Ho1 Ho 0.65280 0.34720 0.81716 1.00000
Ho2 Ho 0.34720 0.65280 0.18284 1.00000
Er1 Er 0.11391 0.88609 0.43947 1.00000
Er2 Er 0.88609 0.11391 0.56053 1.00000
Sc1 Sc 0.00000 0.00000 0.00000 1.00000
Pd1 Pd 0.66528 0.33472 0.22287 1.00000
Pd2 Pd 0.33472 0.66528 0.77713 1.00000
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