Sr2Np5Pd2
Alexandria ALEXAlex-ID: agm009797244 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_1437_spg12
Np SrPd
2024-04-06 15:02:28
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009797244).
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 agm009797244
data_agm009797244
_cell_length_a 4.21795
_cell_length_b 4.66292
_cell_length_c 11.53277
_cell_angle_alpha 102.04051
_cell_angle_beta 83.65730
_cell_angle_gamma 91.18913
_cell_volume 220.47751
_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
Sr1 Sr 0.28251 0.69506 0.38974 1.00000
Sr2 Sr 0.71749 0.30494 0.61026 1.00000
Np1 Np 0.69055 0.52415 0.07103 1.00000
Np2 Np 0.30945 0.47585 0.92897 1.00000
Np3 Np 0.60100 0.89796 0.86077 1.00000
Np4 Np 0.39900 0.10204 0.13923 1.00000
Np5 Np 0.00000 0.00000 0.00000 1.00000
Pd1 Pd 0.17057 0.86040 0.69061 1.00000
Pd2 Pd 0.82943 0.13960 0.30939 1.00000
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