Rb(Np4Sb3)2
Alexandria ALEXAlex-ID: agm072525019 · Space group: R-3 (#148)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_62_spg148
Np2Sb Np4Sb5 RbSb
2024-10-11 15:43:06.737707
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072525019).
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 agm072525019
data_agm072525019
_cell_length_a 8.89925
_cell_length_b 7.92410
_cell_length_c 8.89773
_cell_angle_alpha 90.00161
_cell_angle_beta 120.00705
_cell_angle_gamma 124.12657
_cell_volume 413.89759
_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 0.00000 0.00000 0.50000 1.00000
Np1 Np 0.37612 0.06439 0.18808 1.00000
Np2 Np 0.62388 0.93561 0.81192 1.00000
Np3 Np 0.70961 0.72666 0.72742 1.00000
Np4 Np 0.49931 0.72666 0.98200 1.00000
Np5 Np 0.24490 0.72679 0.51731 1.00000
Np6 Np 0.29039 0.27334 0.27258 1.00000
Np7 Np 0.50069 0.27334 0.01800 1.00000
Np8 Np 0.75510 0.27321 0.48269 1.00000
Sb1 Sb 0.45193 0.74438 0.31836 1.00000
Sb2 Sb 0.92596 0.74410 0.13337 1.00000
Sb3 Sb 0.11078 0.74412 0.79253 1.00000
Sb4 Sb 0.54807 0.25562 0.68164 1.00000
Sb5 Sb 0.07404 0.25590 0.86663 1.00000
Sb6 Sb 0.88922 0.25588 0.20747 1.00000
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