Tm6NiAg3Os2
Alexandria ALEXAlex-ID: agm049913992 · 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
AB2C3D6_175_spg12
Tm2AgOs TmNi TmAg
2025-01-15 04:25:27
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm049913992).
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 agm049913992
data_agm049913992
_cell_length_a 7.62959
_cell_length_b 7.62959
_cell_length_c 8.69003
_cell_angle_alpha 58.27652
_cell_angle_beta 121.72348
_cell_angle_gamma 143.07490
_cell_volume 252.93177
_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
Tm1 Tm 0.42461 0.57539 0.77513 1.00000
Tm2 Tm 0.24248 0.75752 0.22433 1.00000
Tm3 Tm 0.57539 0.42461 0.22487 1.00000
Tm4 Tm 0.09237 0.90763 0.77503 1.00000
Tm5 Tm 0.75752 0.24248 0.77567 1.00000
Tm6 Tm 0.90763 0.09237 0.22497 1.00000
Ni1 Ni 0.00000 0.00000 0.00000 1.00000
Ag1 Ag 0.16626 0.83374 0.49705 1.00000
Ag2 Ag 0.83374 0.16626 0.50295 1.00000
Ag3 Ag 0.50000 0.50000 0.50000 1.00000
Os1 Os 0.33480 0.66520 0.00022 1.00000
Os2 Os 0.66520 0.33480 0.99978 1.00000
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