Er2Pu5Cr2
Alexandria ALEXAlex-ID: agm010050125 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_437_spg12
Er Pu Cr
2024-03-25 06:01:43.699670
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010050125).
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 agm010050125
data_agm010050125
_cell_length_a 3.46967
_cell_length_b 7.70720
_cell_length_c 9.12665
_cell_angle_alpha 59.41404
_cell_angle_beta 70.76297
_cell_angle_gamma 69.69709
_cell_volume 193.48258
_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 0.37480 0.76966 0.37844 1.00000
Er2 Er 0.62520 0.23034 0.62156 1.00000
Pu1 Pu 0.24280 0.30784 0.04442 1.00000
Pu2 Pu 0.75720 0.69216 0.95558 1.00000
Pu3 Pu 0.38955 0.77565 0.72992 1.00000
Pu4 Pu 0.61045 0.22435 0.27008 1.00000
Pu5 Pu 0.00000 0.00000 0.00000 1.00000
Cr1 Cr 0.14368 0.48183 0.30778 1.00000
Cr2 Cr 0.85632 0.51817 0.69222 1.00000
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