Er3Pu2N4
Alexandria ALEXAlex-ID: agm005690811 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_761_spg12
Er4PuN5 PuN Pu
2023-06-27 19:27:33.738898
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005690811).
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 agm005690811
data_agm005690811
_cell_length_a 3.39883
_cell_length_b 5.96490
_cell_length_c 7.87673
_cell_angle_alpha 74.44357
_cell_angle_beta 77.54039
_cell_angle_gamma 73.44699
_cell_volume 145.77607
_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
Er1 Er 0.00000 0.00000 0.00000 1.00000
Er2 Er 0.20898 0.39665 0.18539 1.00000
Er3 Er 0.79102 0.60335 0.81461 1.00000
Pu1 Pu 0.59986 0.19352 0.60676 1.00000
Pu2 Pu 0.40014 0.80648 0.39324 1.00000
N1 N 0.80633 0.08774 0.29960 1.00000
N2 N 0.19367 0.91226 0.70040 1.00000
N3 N 0.39518 0.30579 0.90386 1.00000
N4 N 0.60482 0.69421 0.09614 1.00000
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