Ca2Pu3Co2
Alexandria ALEXAlex-ID: agm010058489 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_26_spg8
PuCo2 Ca Pu
2024-03-03 04:33:53.482526
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010058489).
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 agm010058489
data_agm010058489
_cell_length_a 4.51626
_cell_length_b 4.27584
_cell_length_c 9.12583
_cell_angle_alpha 80.79724
_cell_angle_beta 77.42708
_cell_angle_gamma 68.58123
_cell_volume 159.49354
_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
Ca1 Ca 0.25071 0.79648 0.63103 1.00000
Ca2 Ca 0.74929 0.20352 0.36897 1.00000
Pu1 Pu 0.71374 0.56035 0.91228 1.00000
Pu2 Pu 0.00000 0.00000 0.00000 1.00000
Pu3 Pu 0.28626 0.43965 0.08772 1.00000
Co1 Co 0.43668 0.90178 0.20115 1.00000
Co2 Co 0.56332 0.09822 0.79885 1.00000
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