Rb6MoO8
Alexandria ALEXAlex-ID: agm071585129 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_1110_spg1
Rb4MoO5 Rb2O3
2024-10-07 04:21:58.336223
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm071585129).
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 agm071585129
data_agm071585129
_cell_length_a 4.86858
_cell_length_b 6.69713
_cell_length_c 11.49676
_cell_angle_alpha 93.06281
_cell_angle_beta 96.53972
_cell_angle_gamma 97.47272
_cell_volume 368.36851
_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 0.34678 0.14376 0.63375 1.00000
Rb2 Rb 0.51862 0.19922 0.16028 1.00000
Rb3 Rb 0.14742 0.48961 0.36189 1.00000
Rb4 Rb 0.73364 0.91518 0.41245 1.00000
Rb5 Rb 0.33683 0.63080 0.95111 1.00000
Rb6 Rb 0.80530 0.60410 0.64342 1.00000
Mo1 Mo 0.84487 0.10708 0.89526 1.00000
O1 O 0.00626 0.23091 0.03457 1.00000
O2 O 0.88891 0.84404 0.87459 1.00000
O3 O 0.43528 0.77219 0.19090 1.00000
O4 O 0.47863 0.10554 0.89948 1.00000
O5 O 0.62893 0.29719 0.42486 1.00000
O6 O 0.92884 0.25290 0.77226 1.00000
O7 O 0.62109 0.63715 0.20312 1.00000
O8 O 0.27860 0.77034 0.54207 1.00000
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