CrCd(H4Rh)2
Alexandria ALEXAlex-ID: agm007758284 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_757_spg148
CdH2Rh CrH CdH4 H8Rh3
2024-03-16 02:43:33.766351
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007758284).
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 agm007758284
data_agm007758284
_cell_length_a 5.10813
_cell_length_b 4.76811
_cell_length_c 4.98527
_cell_angle_alpha 63.38317
_cell_angle_beta 88.50921
_cell_angle_gamma 76.17208
_cell_volume 104.94708
_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
Cr1 Cr 0.00000 0.00000 0.00000 1.00000
Cd1 Cd 0.50000 0.00000 0.50000 1.00000
H1 H 0.72153 0.30545 0.48592 1.00000
H2 H 0.82849 0.71173 0.29045 1.00000
H3 H 0.27847 0.69455 0.51408 1.00000
H4 H 0.37252 0.68378 0.06931 1.00000
H5 H 0.62748 0.31622 0.93069 1.00000
H6 H 0.07621 0.26867 0.20315 1.00000
H7 H 0.92379 0.73133 0.79685 1.00000
H8 H 0.17151 0.28827 0.70955 1.00000
Rh1 Rh 0.74441 0.50449 0.12217 1.00000
Rh2 Rh 0.25559 0.49551 0.87783 1.00000
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