Np2CoSi5Rh2
Alexandria ALEXAlex-ID: agm046589770 · Space group: Ibam (#72)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D5_56_spg15
NpCoSi3 Np(SiRh)2
2024-11-09 00:56:52.287028
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm046589770).
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 agm046589770
data_agm046589770
_cell_length_a 8.10872
_cell_length_b 8.10872
_cell_length_c 8.10872
_cell_angle_alpha 139.46410
_cell_angle_beta 105.70635
_cell_angle_gamma 88.24040
_cell_volume 320.25596
_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
Np1 Np 0.40163 0.13425 0.26738 1.00000
Np2 Np 0.86687 0.63425 0.23262 1.00000
Np3 Np 0.59837 0.86575 0.73262 1.00000
Np4 Np 0.13313 0.36575 0.76738 1.00000
Co1 Co 0.00000 0.75000 0.75000 1.00000
Co2 Co 0.00000 0.25000 0.25000 1.00000
Si1 Si 0.75094 0.40486 0.34607 1.00000
Si2 Si 0.05879 0.90486 0.15393 1.00000
Si3 Si 0.24906 0.59514 0.65393 1.00000
Si4 Si 0.94121 0.09514 0.84607 1.00000
Si5 Si 0.50000 0.25000 0.75000 1.00000
Si6 Si 0.50000 0.75000 0.25000 1.00000
Si7 Si 0.21165 0.96165 0.75000 1.00000
Si8 Si 0.78835 0.03835 0.25000 1.00000
Si9 Si 0.78835 0.53835 0.75000 1.00000
Si10 Si 0.21165 0.46165 0.25000 1.00000
Rh1 Rh 0.46532 0.35799 0.10733 1.00000
Rh2 Rh 0.25066 0.85799 0.39267 1.00000
Rh3 Rh 0.53468 0.64201 0.89267 1.00000
Rh4 Rh 0.74934 0.14201 0.60733 1.00000
