Ca2Cd3Rh
Alexandria ALEXAlex-ID: agm019144530 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_8_spg166
CaCd2Rh Ca2Cd2Rh CaCd2
2025-04-13 15:37:00
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm019144530).
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 agm019144530
data_agm019144530
_cell_length_a 4.32400
_cell_length_b 5.87396
_cell_length_c 6.73396
_cell_angle_alpha 74.32465
_cell_angle_beta 71.47028
_cell_angle_gamma 68.42432
_cell_volume 148.50905
_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
Ca1 Ca 0.41871 0.81086 0.35083 1.00000
Ca2 Ca 0.55754 0.18817 0.69641 1.00000
Cd1 Cd 0.14250 0.39401 0.32072 1.00000
Cd2 Cd 0.17926 0.74199 0.90026 1.00000
Cd3 Cd 0.84040 0.25963 0.06011 1.00000
Rh1 Rh 0.86158 0.60534 0.67167 1.00000
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