Tm4Ga(CoGe2)2
Alexandria ALEXAlex-ID: agm020089601 · 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
AB2C4D4_13_spg12
Tm3CoGe3 Tm3(CoGe2)2 Tm5Ga3Co3Ge4 TmGe
2024-12-08 06:40:37
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm020089601).
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 agm020089601
data_agm020089601
_cell_length_a 7.80996
_cell_length_b 7.80996
_cell_length_c 6.84254
_cell_angle_alpha 73.20921
_cell_angle_beta 106.79079
_cell_angle_gamma 148.85547
_cell_volume 205.92507
_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 0.34880 0.65120 0.05796 1.00000
Tm2 Tm 0.65120 0.34880 0.94204 1.00000
Tm3 Tm 0.41166 0.58834 0.61498 1.00000
Tm4 Tm 0.58834 0.41166 0.38502 1.00000
Ga1 Ga 0.00000 0.00000 0.00000 1.00000
Co1 Co 0.22154 0.77846 0.63149 1.00000
Co2 Co 0.77846 0.22154 0.36851 1.00000
Ge1 Ge 0.06726 0.93274 0.66461 1.00000
Ge2 Ge 0.93274 0.06726 0.33539 1.00000
Ge3 Ge 0.20338 0.79662 0.26535 1.00000
Ge4 Ge 0.79662 0.20338 0.73465 1.00000
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