Hf2Np2In5
Alexandria ALEXAlex-ID: agm009750367 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_501_spg12
Hf2In5 Np
2024-03-27 05:13:46
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009750367).
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
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# CIF generated by HEAS from Alexandria entry agm009750367
data_agm009750367
_cell_length_a 7.29400
_cell_length_b 7.29400
_cell_length_c 9.55024
_cell_angle_alpha 73.12637
_cell_angle_beta 73.12637
_cell_angle_gamma 25.23204
_cell_volume 206.79039
_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
Hf1 Hf 0.01014 0.01014 0.31319 1.00000
Hf2 Hf 0.98986 0.98986 0.68681 1.00000
Np1 Np 0.68999 0.68999 0.08069 1.00000
Np2 Np 0.31001 0.31001 0.91931 1.00000
In1 In 0.33088 0.33088 0.25061 1.00000
In2 In 0.66912 0.66912 0.74939 1.00000
In3 In 0.64634 0.64634 0.44155 1.00000
In4 In 0.35366 0.35366 0.55845 1.00000
In5 In 0.00000 0.00000 0.00000 1.00000
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