RbCuGeH6
Alexandria ALEXAlex-ID: agm007666208 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD6_175_spg1
RbH7 RbGeH3 Cu GeH8
2024-02-10 17:04:06
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007666208).
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 agm007666208
data_agm007666208
_cell_length_a 4.61870
_cell_length_b 6.05782
_cell_length_c 7.51331
_cell_angle_alpha 93.95273
_cell_angle_beta 128.12183
_cell_angle_gamma 90.72799
_cell_volume 164.57444
_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 0.68646 0.66180 0.17420 1.00000
Cu1 Cu 0.19063 0.15947 0.16270 1.00000
Ge1 Ge 0.15602 0.17179 0.66747 1.00000
H1 H 0.13742 0.90422 0.12443 1.00000
H2 H 0.35301 0.38591 0.67830 1.00000
H3 H 0.35084 0.97208 0.65765 1.00000
H4 H 0.20495 0.41369 0.20185 1.00000
H5 H 0.74112 0.15662 0.44765 1.00000
H6 H 0.17942 0.17462 0.88570 1.00000
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