RbLa(CdH4)2
Alexandria ALEXAlex-ID: agm007441676 · Space group: C2 (#5)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_323_spg148
LaH3 RbCd11 Rb2CdH4 CdH4
2025-05-28 05:58:34
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007441676).
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 agm007441676
data_agm007441676
_cell_length_a 5.18625
_cell_length_b 5.18617
_cell_length_c 8.53591
_cell_angle_alpha 64.00919
_cell_angle_beta 116.01425
_cell_angle_gamma 110.15526
_cell_volume 182.13158
_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
Rb1 Rb 0.99395 0.99273 0.50039 1.00000
La1 La 0.05869 0.05876 0.00003 1.00000
Cd1 Cd 0.48184 0.55637 0.20724 1.00000
Cd2 Cd 0.55614 0.48182 0.79272 1.00000
H1 H 0.60558 0.16900 0.03144 1.00000
H2 H 0.34115 0.15895 0.28211 1.00000
H3 H 0.86127 0.65724 0.22735 1.00000
H4 H 0.16923 0.60535 0.96838 1.00000
H5 H 0.15842 0.34194 0.71793 1.00000
H6 H 0.65770 0.86121 0.77271 1.00000
H7 H 0.75307 0.36232 0.71348 1.00000
H8 H 0.36296 0.75431 0.28623 1.00000
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