Pu4Fe2SnGe4
Alexandria ALEXAlex-ID: agm020046404 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4D4_13_spg12
PuSn2 Pu3Ge5 Pu2SnGe PuFeGe
2024-12-10 18:36:00
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm020046404).
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 agm020046404
data_agm020046404
_cell_length_a 7.85869
_cell_length_b 7.85869
_cell_length_c 7.19033
_cell_angle_alpha 70.80169
_cell_angle_beta 109.19831
_cell_angle_gamma 147.56721
_cell_volume 223.75642
_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
Pu1 Pu 0.65665 0.34335 0.45074 1.00000
Pu2 Pu 0.34335 0.65665 0.54926 1.00000
Pu3 Pu 0.58642 0.41358 0.88148 1.00000
Pu4 Pu 0.41358 0.58642 0.11852 1.00000
Fe1 Fe 0.77273 0.22727 0.88065 1.00000
Fe2 Fe 0.22727 0.77273 0.11935 1.00000
Sn1 Sn 0.00000 0.00000 0.50000 1.00000
Ge1 Ge 0.92772 0.07228 0.83860 1.00000
Ge2 Ge 0.07228 0.92772 0.16140 1.00000
Ge3 Ge 0.79610 0.20390 0.23751 1.00000
Ge4 Ge 0.20390 0.79610 0.76249 1.00000
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