Np3Ti2Sn3
Alexandria ALEXAlex-ID: agm009588142 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C3_118_spg71
Np2Sn Ti6Sn5 Np
2024-03-19 01:59:02
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009588142).
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 agm009588142
data_agm009588142
_cell_length_a 9.59935
_cell_length_b 9.59935
_cell_length_c 9.59935
_cell_angle_alpha 153.95888
_cell_angle_beta 151.79128
_cell_angle_gamma 38.76590
_cell_volume 183.24943
_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 0.36853 0.86853 0.50000 1.00000
Np2 Np 0.63147 0.13147 0.50000 1.00000
Np3 Np 0.00000 0.00000 0.00000 1.00000
Ti1 Ti 0.74827 0.74827 0.00000 1.00000
Ti2 Ti 0.25173 0.25173 0.00000 1.00000
Sn1 Sn 0.85184 0.35184 0.50000 1.00000
Sn2 Sn 0.50000 0.50000 0.00000 1.00000
Sn3 Sn 0.14816 0.64816 0.50000 1.00000
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