Ce3TmRh3
Alexandria ALEXAlex-ID: agm003545778 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C3_288_spg12
TmRh Ce CeRh
2022-04-04 06:04:35.993557
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003545778).
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 agm003545778
data_agm003545778
_cell_length_a 6.83871
_cell_length_b 6.83871
_cell_length_c 6.94817
_cell_angle_alpha 90.40283
_cell_angle_beta 90.40283
_cell_angle_gamma 97.67440
_cell_volume 322.02290
_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 0.63573 0.63573 0.39139 1.00000
Ce2 Ce 0.18526 0.81474 0.50000 1.00000
Ce3 Ce 0.81474 0.18526 0.50000 1.00000
Ce4 Ce 0.25261 0.74739 0.00000 1.00000
Ce5 Ce 0.74739 0.25261 0.00000 1.00000
Ce6 Ce 0.36427 0.36427 0.60861 1.00000
Tm1 Tm 0.75175 0.75175 0.88352 1.00000
Tm2 Tm 0.24825 0.24825 0.11648 1.00000
Rh1 Rh 0.94041 0.94041 0.21355 1.00000
Rh2 Rh 0.02786 0.48457 0.77023 1.00000
Rh3 Rh 0.48457 0.02786 0.77023 1.00000
Rh4 Rh 0.97214 0.51543 0.22977 1.00000
Rh5 Rh 0.51543 0.97214 0.22977 1.00000
Rh6 Rh 0.05959 0.05959 0.78645 1.00000
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