Sr2Cu6NiRh
Alexandria ALEXAlex-ID: agm004929752 · Space group: R-3 (#148)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_413_spg2
Sr2CuRh SrCu4Ni Sr2Ni3 SrCu4Rh
2022-07-27 17:35:18.015651
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004929752).
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 agm004929752
data_agm004929752
_cell_length_a 6.36343
_cell_length_b 6.39836
_cell_length_c 6.40841
_cell_angle_alpha 59.88644
_cell_angle_beta 59.51149
_cell_angle_gamma 90.06196
_cell_volume 182.70297
_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
Sr1 Sr 0.93494 0.31179 0.37705 1.00000
Sr2 Sr 0.06506 0.68821 0.62295 1.00000
Cu1 Cu 0.39242 0.17128 0.49878 1.00000
Cu2 Cu 0.60864 0.67002 0.21939 1.00000
Cu3 Cu 0.39031 0.88921 0.93982 1.00000
Cu4 Cu 0.60969 0.11079 0.06019 1.00000
Cu5 Cu 0.39136 0.32998 0.78061 1.00000
Cu6 Cu 0.60758 0.82872 0.50122 1.00000
Ni1 Ni 1.00000 1.00000 0.00000 1.00000
Rh1 Rh 0.50000 0.50000 0.00000 1.00000
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