Ce6GeRu5
Alexandria ALEXAlex-ID: agm003674978 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_49_spg12
Ce5Ge2Ru Ce3(GeRu)2 CeRu
2022-04-09 22:04:39.703464
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003674978).
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
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm003674978
data_agm003674978
_cell_length_a 7.18268
_cell_length_b 7.03180
_cell_length_c 6.51483
_cell_angle_alpha 57.33840
_cell_angle_beta 81.90224
_cell_angle_gamma 74.86981
_cell_volume 267.41180
_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
Ce1 Ce 0.72485 0.09469 0.34373 1.00000
Ce2 Ce 0.27515 0.56157 0.34373 1.00000
Ce3 Ce 0.22472 0.28157 1.00000 1.00000
Ce4 Ce 0.77528 0.71843 0.00000 1.00000
Ce5 Ce 0.72485 0.43843 0.65627 1.00000
Ce6 Ce 0.27515 0.90531 0.65627 1.00000
Ge1 Ge 0.00000 0.00000 0.00000 1.00000
Ru1 Ru 0.50000 0.13170 0.73660 1.00000
Ru2 Ru 0.00000 0.29902 0.40197 1.00000
Ru3 Ru 0.50000 0.50000 0.00000 1.00000
Ru4 Ru 1.00000 0.70098 0.59803 1.00000
Ru5 Ru 0.50000 0.86830 0.26340 1.00000
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