CeIn7Ru2
Alexandria ALEXAlex-ID: agm002180987 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C7_40_spg139
CeIn3 In3Ru CeIn2Ru
2018-06-09 21:10:09
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002180987).
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}
}
3D Crystal Structure Rendering
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# CIF generated by HEAS from Alexandria entry agm002180987
data_agm002180987
_cell_length_a 4.56919
_cell_length_b 4.56942
_cell_length_c 11.85358
_cell_angle_alpha 101.06836
_cell_angle_beta 101.06367
_cell_angle_gamma 89.91498
_cell_volume 238.20692
_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
Ru1 Ru 0.67751 0.67908 0.36059 1.00000
Ru2 Ru 0.31973 0.32067 0.63912 1.00000
Ce1 Ce 0.99857 0.99988 0.99982 1.00000
In1 In 0.61026 0.11077 0.22247 1.00000
In2 In 0.88809 0.38790 0.77727 1.00000
In3 In 0.10916 0.61189 0.22248 1.00000
In4 In 0.49874 0.50007 0.00020 1.00000
In5 In 0.24731 0.75096 0.49986 1.00000
In6 In 0.38698 0.88901 0.77728 1.00000
In7 In 0.74995 0.24879 0.49986 1.00000
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