RbNO4
Alexandria ALEXAlex-ID: agm005889752 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_3195_spg2
RbNO4
2023-07-31 00:52:53.456301
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005889752).
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 agm005889752
data_agm005889752
_cell_length_a 8.87128
_cell_length_b 5.87046
_cell_length_c 6.44248
_cell_angle_alpha 122.65340
_cell_angle_beta 119.33058
_cell_angle_gamma 58.37959
_cell_volume 230.30808
_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 0.25726 0.14267 0.66402 1.00000
Rb2 Rb 0.74274 0.85733 0.33598 1.00000
N1 N 0.27544 0.42929 0.32205 1.00000
N2 N 0.72456 0.57071 0.67795 1.00000
O1 O 0.02984 0.92863 0.90609 1.00000
O2 O 0.69229 0.46253 0.77054 1.00000
O3 O 0.17334 0.59328 0.47262 1.00000
O4 O 0.82666 0.40672 0.52738 1.00000
O5 O 0.65603 0.84171 0.73460 1.00000
O6 O 0.30771 0.53747 0.22946 1.00000
O7 O 0.34397 0.15829 0.26540 1.00000
O8 O 0.97016 0.07137 0.09391 1.00000
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