Dy4NpO10
Alexandria ALEXAlex-ID: agm005995332 · Space group: I4/m (#87)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C10_7_spg87
DyNpO5 Dy6NpO12 DyO2
2023-08-08 09:55:04.999813
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005995332).
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 agm005995332
data_agm005995332
_cell_length_a 5.30708
_cell_length_b 6.56692
_cell_length_c 6.56692
_cell_angle_alpha 80.60280
_cell_angle_beta 66.16672
_cell_angle_gamma 66.16673
_cell_volume 191.49648
_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
Dy1 Dy 0.40132 0.79762 0.39974 1.00000
Dy2 Dy 0.80106 0.60026 0.79762 1.00000
Dy3 Dy 0.19894 0.39974 0.20238 1.00000
Dy4 Dy 0.59868 0.20238 0.60026 1.00000
Np1 Np 0.00000 0.00000 0.00000 1.00000
O1 O 0.25000 0.50000 0.50000 1.00000
O2 O 0.66692 0.28353 0.91049 1.00000
O3 O 0.04955 0.08951 0.28353 1.00000
O4 O 0.42258 0.91049 0.71647 1.00000
O5 O 0.86095 0.71647 0.08951 1.00000
O6 O 0.33308 0.71647 0.08951 1.00000
O7 O 0.75000 0.50000 0.50000 1.00000
O8 O 0.13905 0.28353 0.91049 1.00000
O9 O 0.57742 0.08951 0.28353 1.00000
O10 O 0.95045 0.91049 0.71647 1.00000
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